(2S,3R)-2-amino-1-[(2S)-2-[(5-phenylsulfanyltetrazol-1-yl)methyl]pyrrolidin-1-yl]-3-prop-2-ynoxybutan-1-one;3-bromoprop-1-yne;tert-butyl N-methyl-N-[(2S)-1-oxo-1-[[(2S,3R)-1-oxo-1-[(2S)-2-[(5-phenylsulfanyltetrazol-1-yl)methyl]pyrrolidin-1-yl]-3-prop-2-ynoxybutan-2-yl]amino]propan-2-yl]carbamate;tert-butyl N-[(2S,3R)-1-oxo-1-[(2S)-2-[(5-phenylsulfanyltetrazol-1-yl)methyl]pyrrolidin-1-yl]-3-prop-2-ynoxybutan-2-yl]carbamate;deuterio(fluoro)methane;(2S,3R)-3-hydroxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoic acid;imino-[[(2S)-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidin-2-yl]methylimino]azanium;(2S)-2-(methylamino)-N-[(2S,3R)-1-oxo-1-[(2S)-2-[(5-phenylsulfanyltetrazol-1-yl)methyl]pyrrolidin-1-yl]-3-prop-2-ynoxybutan-2-yl]propanamide;(2S)-2-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]propanoic acid;(2S,3R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-prop-2-ynoxybutanoic acid;5-phenylsulfanyl-1-[[(2S)-pyrrolidin-2-yl]methyl]tetrazole

C150H219BrFN38O30S5+ — CID 159176927

About (2S,3R)-2-amino-1-[(2S)-2-[(5-phenylsulfanyltetrazol-1-yl)methyl]pyrrolidin-1-yl]-3-prop-2-ynoxybutan-1-one;3-bromoprop-1-yne;tert-butyl N-methyl-N-[(2S)-1-oxo-1-[[(2S,3R)-1-oxo-1-[(2S)-2-[(5-phenylsulfanyltetrazol-1-yl)methyl]pyrrolidin-1-yl]-3-prop-2-ynoxybutan-2-yl]amino]propan-2-yl]carbamate;tert-butyl N-[(2S,3R)-1-oxo-1-[(2S)-2-[(5-phenylsulfanyltetrazol-1-yl)methyl]pyrrolidin-1-yl]-3-prop-2-ynoxybutan-2-yl]carbamate;deuterio(fluoro)methane;(2S,3R)-3-hydroxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoic acid;imino-[[(2S)-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidin-2-yl]methylimino]azanium;(2S)-2-(methylamino)-N-[(2S,3R)-1-oxo-1-[(2S)-2-[(5-phenylsulfanyltetrazol-1-yl)methyl]pyrrolidin-1-yl]-3-prop-2-ynoxybutan-2-yl]propanamide;(2S)-2-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]propanoic acid;(2S,3R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-prop-2-ynoxybutanoic acid;5-phenylsulfanyl-1-[[(2S)-pyrrolidin-2-yl]methyl]tetrazole

(2S,3R)-2-amino-1-[(2S)-2-[(5-phenylsulfanyltetrazol-1-yl)methyl]pyrrolidin-1-yl]-3-prop-2-ynoxybutan-1-one;3-bromoprop-1-yne;tert-butyl N-methyl-N-[(2S)-1-oxo-1-[[(2S,3R)-1-oxo-1-[(2S)-2-[(5-phenylsulfanyltetrazol-1-yl)methyl]pyrrolidin-1-yl]-3-prop-2-ynoxybutan-2-yl]amino]propan-2-yl]carbamate;tert-butyl N-[(2S,3R)-1-oxo-1-[(2S)-2-[(5-phenylsulfanyltetrazol-1-yl)methyl]pyrrolidin-1-yl]-3-prop-2-ynoxybutan-2-yl]carbamate;deuterio(fluoro)methane;(2S,3R)-3-hydroxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoic acid;imino-[[(2S)-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidin-2-yl]methylimino]azanium;(2S)-2-(methylamino)-N-[(2S,3R)-1-oxo-1-[(2S)-2-[(5-phenylsulfanyltetrazol-1-yl)methyl]pyrrolidin-1-yl]-3-prop-2-ynoxybutan-2-yl]propanamide;(2S)-2-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]propanoic acid;(2S,3R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-prop-2-ynoxybutanoic acid;5-phenylsulfanyl-1-[[(2S)-pyrrolidin-2-yl]methyl]tetrazole (PubChem CID 159176927) has the molecular formula C150H219BrFN38O30S5+ and a molecular weight of 3294.88 g/mol. Its IUPAC name is (2S,3R)-2-amino-1-[(2S)-2-[(5-phenylsulfanyltetrazol-1-yl)methyl]pyrrolidin-1-yl]-3-prop-2-ynoxybutan-1-one;3-bromoprop-1-yne;tert-butyl N-methyl-N-[(2S)-1-oxo-1-[[(2S,3R)-1-oxo-1-[(2S)-2-[(5-phenylsulfanyltetrazol-1-yl)methyl]pyrrolidin-1-yl]-3-prop-2-ynoxybutan-2-yl]amino]propan-2-yl]carbamate;tert-butyl N-[(2S,3R)-1-oxo-1-[(2S)-2-[(5-phenylsulfanyltetrazol-1-yl)methyl]pyrrolidin-1-yl]-3-prop-2-ynoxybutan-2-yl]carbamate;deuterio(fluoro)methane;(2S,3R)-3-hydroxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoic acid;imino-[[(2S)-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidin-2-yl]methylimino]azanium;(2S)-2-(methylamino)-N-[(2S,3R)-1-oxo-1-[(2S)-2-[(5-phenylsulfanyltetrazol-1-yl)methyl]pyrrolidin-1-yl]-3-prop-2-ynoxybutan-2-yl]propanamide;(2S)-2-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]propanoic acid;(2S,3R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-prop-2-ynoxybutanoic acid;5-phenylsulfanyl-1-[[(2S)-pyrrolidin-2-yl]methyl]tetrazole.

Molecular Properties

• Compound Name: (2S,3R)-2-amino-1-[(2S)-2-[(5-phenylsulfanyltetrazol-1-yl)methyl]pyrrolidin-1-yl]-3-prop-2-ynoxybutan-1-one;3-bromoprop-1-yne;tert-butyl N-methyl-N-[(2S)-1-oxo-1-[[(2S,3R)-1-oxo-1-[(2S)-2-[(5-phenylsulfanyltetrazol-1-yl)methyl]pyrrolidin-1-yl]-3-prop-2-ynoxybutan-2-yl]amino]propan-2-yl]carbamate;tert-butyl N-[(2S,3R)-1-oxo-1-[(2S)-2-[(5-phenylsulfanyltetrazol-1-yl)methyl]pyrrolidin-1-yl]-3-prop-2-ynoxybutan-2-yl]carbamate;deuterio(fluoro)methane;(2S,3R)-3-hydroxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoic acid;imino-[[(2S)-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidin-2-yl]methylimino]azanium;(2S)-2-(methylamino)-N-[(2S,3R)-1-oxo-1-[(2S)-2-[(5-phenylsulfanyltetrazol-1-yl)methyl]pyrrolidin-1-yl]-3-prop-2-ynoxybutan-2-yl]propanamide;(2S)-2-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]propanoic acid;(2S,3R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-prop-2-ynoxybutanoic acid;5-phenylsulfanyl-1-[[(2S)-pyrrolidin-2-yl]methyl]tetrazole
• PubChem CID: 159176927
• Molecular Formula: C150H219BrFN38O30S5+
• Molecular Weight: 3294.88 g/mol
• Exact Mass: 3291.46
• IUPAC Name: (2S,3R)-2-amino-1-[(2S)-2-[(5-phenylsulfanyltetrazol-1-yl)methyl]pyrrolidin-1-yl]-3-prop-2-ynoxybutan-1-one;3-bromoprop-1-yne;tert-butyl N-methyl-N-[(2S)-1-oxo-1-[[(2S,3R)-1-oxo-1-[(2S)-2-[(5-phenylsulfanyltetrazol-1-yl)methyl]pyrrolidin-1-yl]-3-prop-2-ynoxybutan-2-yl]amino]propan-2-yl]carbamate;tert-butyl N-[(2S,3R)-1-oxo-1-[(2S)-2-[(5-phenylsulfanyltetrazol-1-yl)methyl]pyrrolidin-1-yl]-3-prop-2-ynoxybutan-2-yl]carbamate;deuterio(fluoro)methane;(2S,3R)-3-hydroxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoic acid;imino-[[(2S)-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidin-2-yl]methylimino]azanium;(2S)-2-(methylamino)-N-[(2S,3R)-1-oxo-1-[(2S)-2-[(5-phenylsulfanyltetrazol-1-yl)methyl]pyrrolidin-1-yl]-3-prop-2-ynoxybutan-2-yl]propanamide;(2S)-2-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]propanoic acid;(2S,3R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-prop-2-ynoxybutanoic acid;5-phenylsulfanyl-1-[[(2S)-pyrrolidin-2-yl]methyl]tetrazole
• SMILES: C#CCBr.C#CCO[C@H](C)[C@H](N)C(=O)N1CCC[C@H]1Cn1nnnc1Sc1ccccc1.C#CCO[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@H]1Cn1nnnc1Sc1ccccc1.C#CCO[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)O.C#CCO[C@H](C)[C@H](NC(=O)[C@H](C)N(C)C(=O)OC(C)(C)C)C(=O)N1CCC[C@H]1Cn1nnnc1Sc1ccccc1.C#CCO[C@H](C)[C@H](NC(=O)[C@H](C)NC)C(=O)N1CCC[C@H]1Cn1nnnc1Sc1ccccc1.CC(C)(C)OC(=O)N1CCC[C@H]1CN=[N+]=N.C[C@@H](C(=O)O)N(C)C(=O)OC(C)(C)C.C[C@@H](O)[C@H](NC(=O)OC(C)(C)C)C(=O)O.[2H]CF.c1ccc(Sc2nnnn2C[C@@H]2CCCN2)cc1
• InChI: InChI=1S/C28H39N7O5S.C24H32N6O4S.C23H31N7O3S.C19H24N6O2S.C12H15N5S.C12H19NO5.C10H19N4O2.C9H17NO5.C9H17NO4.C3H3Br.CH3F/c1-8-17-39-20(3)23(29-24(36)19(2)33(7)27(38)40-28(4,5)6)25(37)34-16-12-13-21(34)18-35-26(30-31-32-35)41-22-14-10-9-11-15-22;1-6-15-33-17(2)20(25-23(32)34-24(3,4)5)21(31)29-14-10-11-18(29)16-30-22(26-27-28-30)35-19-12-8-7-9-13-19;1-5-14-33-17(3)20(25-21(31)16(2)24-4)22(32)29-13-9-10-18(29)15-30-23(26-27-28-30)34-19-11-7-6-8-12-19;1-3-12-27-14(2)17(20)18(26)24-11-7-8-15(24)13-25-19(21-22-23-25)28-16-9-5-4-6-10-16;1-2-6-11(7-3-1)18-12-14-15-16-17(12)9-10-5-4-8-13-10;1-6-7-17-8(2)9(10(14)15)13-11(16)18-12(3,4)5;1-10(2,3)16-9(15)14-6-4-5-8(14)7-12-13-11;1-5(11)6(7(12)13)10-8(14)15-9(2,3)4;1-6(7(11)12)10(5)8(13)14-9(2,3)4;1-2-3-4;1-2/h1,9-11,14-15,19-21,23H,12-13,16-18H2,2-7H3,(H,29,36);1,7-9,12-13,17-18,20H,10-11,14-16H2,2-5H3,(H,25,32);1,6-8,11-12,16-18,20,24H,9-10,13-15H2,2-4H3,(H,25,31);1,4-6,9-10,14-15,17H,7-8,11-13,20H2,2H3;1-3,6-7,10,13H,4-5,8-9H2;1,8-9H,7H2,2-5H3,(H,13,16)(H,14,15);8,11H,4-7H2,1-3H3;5-6,11H,1-4H3,(H,10,14)(H,12,13);6H,1-5H3,(H,11,12);1H,3H2;1H3/q;;;;;;+1;;;;/t19-,20+,21-,23-;17-,18+,20+;16-,17+,18-,20-;14-,15+,17+;10-;8-,9+;8-;5-,6+;6-;;/m010101010../s1/i;;;;;;;;;;1D
• InChIKey: LDFYSCJSWITYMH-LDAZSBOESA-N
• XLogP: 15.25
• TPSA: 839.72 Ų
• H-Bond Donors: 13
• H-Bond Acceptors: 57
• Rotatable Bonds: 55
• Heavy Atoms: 225
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	3294.88
LogP ≤ 5	15.25
H-Bond Donors ≤ 5	13
H-Bond Acceptors ≤ 10	57

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_3', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of (2S,3R)-2-amino-1-[(2S)-2-[(5-phenylsulfanyltetrazol-1-yl)methyl]pyrrolidin-1-yl]-3-prop-2-ynoxybutan-1-one;3-bromoprop-1-yne;tert-butyl N-methyl-N-[(2S)-1-oxo-1-[[(2S,3R)-1-oxo-1-[(2S)-2-[(5-phenylsulfanyltetrazol-1-yl)methyl]pyrrolidin-1-yl]-3-prop-2-ynoxybutan-2-yl]amino]propan-2-yl]carbamate;tert-butyl N-[(2S,3R)-1-oxo-1-[(2S)-2-[(5-phenylsulfanyltetrazol-1-yl)methyl]pyrrolidin-1-yl]-3-prop-2-ynoxybutan-2-yl]carbamate;deuterio(fluoro)methane;(2S,3R)-3-hydroxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoic acid;imino-[[(2S)-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidin-2-yl]methylimino]azanium;(2S)-2-(methylamino)-N-[(2S,3R)-1-oxo-1-[(2S)-2-[(5-phenylsulfanyltetrazol-1-yl)methyl]pyrrolidin-1-yl]-3-prop-2-ynoxybutan-2-yl]propanamide;(2S)-2-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]propanoic acid;(2S,3R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-prop-2-ynoxybutanoic acid;5-phenylsulfanyl-1-[[(2S)-pyrrolidin-2-yl]methyl]tetrazole?

The IUPAC name of (2S,3R)-2-amino-1-[(2S)-2-[(5-phenylsulfanyltetrazol-1-yl)methyl]pyrrolidin-1-yl]-3-prop-2-ynoxybutan-1-one;3-bromoprop-1-yne;tert-butyl N-methyl-N-[(2S)-1-oxo-1-[[(2S,3R)-1-oxo-1-[(2S)-2-[(5-phenylsulfanyltetrazol-1-yl)methyl]pyrrolidin-1-yl]-3-prop-2-ynoxybutan-2-yl]amino]propan-2-yl]carbamate;tert-butyl N-[(2S,3R)-1-oxo-1-[(2S)-2-[(5-phenylsulfanyltetrazol-1-yl)methyl]pyrrolidin-1-yl]-3-prop-2-ynoxybutan-2-yl]carbamate;deuterio(fluoro)methane;(2S,3R)-3-hydroxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoic acid;imino-[[(2S)-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidin-2-yl]methylimino]azanium;(2S)-2-(methylamino)-N-[(2S,3R)-1-oxo-1-[(2S)-2-[(5-phenylsulfanyltetrazol-1-yl)methyl]pyrrolidin-1-yl]-3-prop-2-ynoxybutan-2-yl]propanamide;(2S)-2-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]propanoic acid;(2S,3R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-prop-2-ynoxybutanoic acid;5-phenylsulfanyl-1-[[(2S)-pyrrolidin-2-yl]methyl]tetrazole (CID 159176927) is (2S,3R)-2-amino-1-[(2S)-2-[(5-phenylsulfanyltetrazol-1-yl)methyl]pyrrolidin-1-yl]-3-prop-2-ynoxybutan-1-one;3-bromoprop-1-yne;tert-butyl N-methyl-N-[(2S)-1-oxo-1-[[(2S,3R)-1-oxo-1-[(2S)-2-[(5-phenylsulfanyltetrazol-1-yl)methyl]pyrrolidin-1-yl]-3-prop-2-ynoxybutan-2-yl]amino]propan-2-yl]carbamate;tert-butyl N-[(2S,3R)-1-oxo-1-[(2S)-2-[(5-phenylsulfanyltetrazol-1-yl)methyl]pyrrolidin-1-yl]-3-prop-2-ynoxybutan-2-yl]carbamate;deuterio(fluoro)methane;(2S,3R)-3-hydroxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoic acid;imino-[[(2S)-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidin-2-yl]methylimino]azanium;(2S)-2-(methylamino)-N-[(2S,3R)-1-oxo-1-[(2S)-2-[(5-phenylsulfanyltetrazol-1-yl)methyl]pyrrolidin-1-yl]-3-prop-2-ynoxybutan-2-yl]propanamide;(2S)-2-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]propanoic acid;(2S,3R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-prop-2-ynoxybutanoic acid;5-phenylsulfanyl-1-[[(2S)-pyrrolidin-2-yl]methyl]tetrazole.

What is the SMILES notation for (2S,3R)-2-amino-1-[(2S)-2-[(5-phenylsulfanyltetrazol-1-yl)methyl]pyrrolidin-1-yl]-3-prop-2-ynoxybutan-1-one;3-bromoprop-1-yne;tert-butyl N-methyl-N-[(2S)-1-oxo-1-[[(2S,3R)-1-oxo-1-[(2S)-2-[(5-phenylsulfanyltetrazol-1-yl)methyl]pyrrolidin-1-yl]-3-prop-2-ynoxybutan-2-yl]amino]propan-2-yl]carbamate;tert-butyl N-[(2S,3R)-1-oxo-1-[(2S)-2-[(5-phenylsulfanyltetrazol-1-yl)methyl]pyrrolidin-1-yl]-3-prop-2-ynoxybutan-2-yl]carbamate;deuterio(fluoro)methane;(2S,3R)-3-hydroxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoic acid;imino-[[(2S)-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidin-2-yl]methylimino]azanium;(2S)-2-(methylamino)-N-[(2S,3R)-1-oxo-1-[(2S)-2-[(5-phenylsulfanyltetrazol-1-yl)methyl]pyrrolidin-1-yl]-3-prop-2-ynoxybutan-2-yl]propanamide;(2S)-2-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]propanoic acid;(2S,3R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-prop-2-ynoxybutanoic acid;5-phenylsulfanyl-1-[[(2S)-pyrrolidin-2-yl]methyl]tetrazole?

The canonical SMILES for (2S,3R)-2-amino-1-[(2S)-2-[(5-phenylsulfanyltetrazol-1-yl)methyl]pyrrolidin-1-yl]-3-prop-2-ynoxybutan-1-one;3-bromoprop-1-yne;tert-butyl N-methyl-N-[(2S)-1-oxo-1-[[(2S,3R)-1-oxo-1-[(2S)-2-[(5-phenylsulfanyltetrazol-1-yl)methyl]pyrrolidin-1-yl]-3-prop-2-ynoxybutan-2-yl]amino]propan-2-yl]carbamate;tert-butyl N-[(2S,3R)-1-oxo-1-[(2S)-2-[(5-phenylsulfanyltetrazol-1-yl)methyl]pyrrolidin-1-yl]-3-prop-2-ynoxybutan-2-yl]carbamate;deuterio(fluoro)methane;(2S,3R)-3-hydroxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoic acid;imino-[[(2S)-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidin-2-yl]methylimino]azanium;(2S)-2-(methylamino)-N-[(2S,3R)-1-oxo-1-[(2S)-2-[(5-phenylsulfanyltetrazol-1-yl)methyl]pyrrolidin-1-yl]-3-prop-2-ynoxybutan-2-yl]propanamide;(2S)-2-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]propanoic acid;(2S,3R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-prop-2-ynoxybutanoic acid;5-phenylsulfanyl-1-[[(2S)-pyrrolidin-2-yl]methyl]tetrazole is C#CCBr.C#CCO[C@H](C)[C@H](N)C(=O)N1CCC[C@H]1Cn1nnnc1Sc1ccccc1.C#CCO[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@H]1Cn1nnnc1Sc1ccccc1.C#CCO[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)O.C#CCO[C@H](C)[C@H](NC(=O)[C@H](C)N(C)C(=O)OC(C)(C)C)C(=O)N1CCC[C@H]1Cn1nnnc1Sc1ccccc1.C#CCO[C@H](C)[C@H](NC(=O)[C@H](C)NC)C(=O)N1CCC[C@H]1Cn1nnnc1Sc1ccccc1.CC(C)(C)OC(=O)N1CCC[C@H]1CN=[N+]=N.C[C@@H](C(=O)O)N(C)C(=O)OC(C)(C)C.C[C@@H](O)[C@H](NC(=O)OC(C)(C)C)C(=O)O.[2H]CF.c1ccc(Sc2nnnn2C[C@@H]2CCCN2)cc1.

What is the InChIKey of (2S,3R)-2-amino-1-[(2S)-2-[(5-phenylsulfanyltetrazol-1-yl)methyl]pyrrolidin-1-yl]-3-prop-2-ynoxybutan-1-one;3-bromoprop-1-yne;tert-butyl N-methyl-N-[(2S)-1-oxo-1-[[(2S,3R)-1-oxo-1-[(2S)-2-[(5-phenylsulfanyltetrazol-1-yl)methyl]pyrrolidin-1-yl]-3-prop-2-ynoxybutan-2-yl]amino]propan-2-yl]carbamate;tert-butyl N-[(2S,3R)-1-oxo-1-[(2S)-2-[(5-phenylsulfanyltetrazol-1-yl)methyl]pyrrolidin-1-yl]-3-prop-2-ynoxybutan-2-yl]carbamate;deuterio(fluoro)methane;(2S,3R)-3-hydroxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoic acid;imino-[[(2S)-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidin-2-yl]methylimino]azanium;(2S)-2-(methylamino)-N-[(2S,3R)-1-oxo-1-[(2S)-2-[(5-phenylsulfanyltetrazol-1-yl)methyl]pyrrolidin-1-yl]-3-prop-2-ynoxybutan-2-yl]propanamide;(2S)-2-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]propanoic acid;(2S,3R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-prop-2-ynoxybutanoic acid;5-phenylsulfanyl-1-[[(2S)-pyrrolidin-2-yl]methyl]tetrazole?

The InChIKey is LDFYSCJSWITYMH-LDAZSBOESA-N. The full InChI is InChI=1S/C28H39N7O5S.C24H32N6O4S.C23H31N7O3S.C19H24N6O2S.C12H15N5S.C12H19NO5.C10H19N4O2.C9H17NO5.C9H17NO4.C3H3Br.CH3F/c1-8-17-39-20(3)23(29-24(36)19(2)33(7)27(38)40-28(4,5)6)25(37)34-16-12-13-21(34)18-35-26(30-31-32-35)41-22-14-10-9-11-15-22;1-6-15-33-17(2)20(25-23(32)34-24(3,4)5)21(31)29-14-10-11-18(29)16-30-22(26-27-28-30)35-19-12-8-7-9-13-19;1-5-14-33-17(3)20(25-21(31)16(2)24-4)22(32)29-13-9-10-18(29)15-30-23(26-27-28-30)34-19-11-7-6-8-12-19;1-3-12-27-14(2)17(20)18(26)24-11-7-8-15(24)13-25-19(21-22-23-25)28-16-9-5-4-6-10-16;1-2-6-11(7-3-1)18-12-14-15-16-17(12)9-10-5-4-8-13-10;1-6-7-17-8(2)9(10(14)15)13-11(16)18-12(3,4)5;1-10(2,3)16-9(15)14-6-4-5-8(14)7-12-13-11;1-5(11)6(7(12)13)10-8(14)15-9(2,3)4;1-6(7(11)12)10(5)8(13)14-9(2,3)4;1-2-3-4;1-2/h1,9-11,14-15,19-21,23H,12-13,16-18H2,2-7H3,(H,29,36);1,7-9,12-13,17-18,20H,10-11,14-16H2,2-5H3,(H,25,32);1,6-8,11-12,16-18,20,24H,9-10,13-15H2,2-4H3,(H,25,31);1,4-6,9-10,14-15,17H,7-8,11-13,20H2,2H3;1-3,6-7,10,13H,4-5,8-9H2;1,8-9H,7H2,2-5H3,(H,13,16)(H,14,15);8,11H,4-7H2,1-3H3;5-6,11H,1-4H3,(H,10,14)(H,12,13);6H,1-5H3,(H,11,12);1H,3H2;1H3/q;;;;;;+1;;;;/t19-,20+,21-,23-;17-,18+,20+;16-,17+,18-,20-;14-,15+,17+;10-;8-,9+;8-;5-,6+;6-;;/m010101010../s1/i;;;;;;;;;;1D.

What are the key properties of (2S,3R)-2-amino-1-[(2S)-2-[(5-phenylsulfanyltetrazol-1-yl)methyl]pyrrolidin-1-yl]-3-prop-2-ynoxybutan-1-one;3-bromoprop-1-yne;tert-butyl N-methyl-N-[(2S)-1-oxo-1-[[(2S,3R)-1-oxo-1-[(2S)-2-[(5-phenylsulfanyltetrazol-1-yl)methyl]pyrrolidin-1-yl]-3-prop-2-ynoxybutan-2-yl]amino]propan-2-yl]carbamate;tert-butyl N-[(2S,3R)-1-oxo-1-[(2S)-2-[(5-phenylsulfanyltetrazol-1-yl)methyl]pyrrolidin-1-yl]-3-prop-2-ynoxybutan-2-yl]carbamate;deuterio(fluoro)methane;(2S,3R)-3-hydroxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoic acid;imino-[[(2S)-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidin-2-yl]methylimino]azanium;(2S)-2-(methylamino)-N-[(2S,3R)-1-oxo-1-[(2S)-2-[(5-phenylsulfanyltetrazol-1-yl)methyl]pyrrolidin-1-yl]-3-prop-2-ynoxybutan-2-yl]propanamide;(2S)-2-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]propanoic acid;(2S,3R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-prop-2-ynoxybutanoic acid;5-phenylsulfanyl-1-[[(2S)-pyrrolidin-2-yl]methyl]tetrazole?

(2S,3R)-2-amino-1-[(2S)-2-[(5-phenylsulfanyltetrazol-1-yl)methyl]pyrrolidin-1-yl]-3-prop-2-ynoxybutan-1-one;3-bromoprop-1-yne;tert-butyl N-methyl-N-[(2S)-1-oxo-1-[[(2S,3R)-1-oxo-1-[(2S)-2-[(5-phenylsulfanyltetrazol-1-yl)methyl]pyrrolidin-1-yl]-3-prop-2-ynoxybutan-2-yl]amino]propan-2-yl]carbamate;tert-butyl N-[(2S,3R)-1-oxo-1-[(2S)-2-[(5-phenylsulfanyltetrazol-1-yl)methyl]pyrrolidin-1-yl]-3-prop-2-ynoxybutan-2-yl]carbamate;deuterio(fluoro)methane;(2S,3R)-3-hydroxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoic acid;imino-[[(2S)-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidin-2-yl]methylimino]azanium;(2S)-2-(methylamino)-N-[(2S,3R)-1-oxo-1-[(2S)-2-[(5-phenylsulfanyltetrazol-1-yl)methyl]pyrrolidin-1-yl]-3-prop-2-ynoxybutan-2-yl]propanamide;(2S)-2-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]propanoic acid;(2S,3R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-prop-2-ynoxybutanoic acid;5-phenylsulfanyl-1-[[(2S)-pyrrolidin-2-yl]methyl]tetrazole has a molecular weight of 3294.88 g/mol, XLogP of 15.25, 55 rotatable bonds, 13 hydrogen bond donors, and 57 hydrogen bond acceptors.

Where does this data come from?

All data for (2S,3R)-2-amino-1-[(2S)-2-[(5-phenylsulfanyltetrazol-1-yl)methyl]pyrrolidin-1-yl]-3-prop-2-ynoxybutan-1-one;3-bromoprop-1-yne;tert-butyl N-methyl-N-[(2S)-1-oxo-1-[[(2S,3R)-1-oxo-1-[(2S)-2-[(5-phenylsulfanyltetrazol-1-yl)methyl]pyrrolidin-1-yl]-3-prop-2-ynoxybutan-2-yl]amino]propan-2-yl]carbamate;tert-butyl N-[(2S,3R)-1-oxo-1-[(2S)-2-[(5-phenylsulfanyltetrazol-1-yl)methyl]pyrrolidin-1-yl]-3-prop-2-ynoxybutan-2-yl]carbamate;deuterio(fluoro)methane;(2S,3R)-3-hydroxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoic acid;imino-[[(2S)-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidin-2-yl]methylimino]azanium;(2S)-2-(methylamino)-N-[(2S,3R)-1-oxo-1-[(2S)-2-[(5-phenylsulfanyltetrazol-1-yl)methyl]pyrrolidin-1-yl]-3-prop-2-ynoxybutan-2-yl]propanamide;(2S)-2-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]propanoic acid;(2S,3R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-prop-2-ynoxybutanoic acid;5-phenylsulfanyl-1-[[(2S)-pyrrolidin-2-yl]methyl]tetrazole is sourced from PubChem (CID 159176927), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).