tert-butyl 2-(aminomethyl)pyrrolidine-1-carboxylate;tert-butyl 2-[[(1-amino-4-oxo-3-phenylmethoxypyridine-2-carbonyl)amino]methyl]pyrrolidine-1-carboxylate;9-[(11S)-7,8-difluoro-6,11-dihydrobenzo[c][1]benzothiepin-11-yl]-4-hydroxy-1,8,9,12-tetrazatetracyclo[8.7.0.03,8.012,16]heptadeca-3,6-diene-2,5,11-trione;9-[(11S)-7,8-difluoro-6,11-dihydrobenzo[c][1]benzothiepin-11-yl]-4-phenylmethoxy-1,8,9,12-tetrazatetracyclo[8.7.0.03,8.012,16]heptadeca-3,6-diene-2,5,11-trione;ethyl 3-[[1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidin-2-yl]methyl]-4,6-dioxo-5-phenylmethoxy-1,2-dihydropyrido[2,1-f][1,2,4]triazine-2-carboxylate;methane;4-phenylmethoxy-1,8,9,12-tetrazatetracyclo[8.7.0.03,8.012,16]heptadeca-3,6-diene-2,5,11-trione

C143H162F4N22O26S2 — CID 158482682

About tert-butyl 2-(aminomethyl)pyrrolidine-1-carboxylate;tert-butyl 2-[[(1-amino-4-oxo-3-phenylmethoxypyridine-2-carbonyl)amino]methyl]pyrrolidine-1-carboxylate;9-[(11S)-7,8-difluoro-6,11-dihydrobenzo[c][1]benzothiepin-11-yl]-4-hydroxy-1,8,9,12-tetrazatetracyclo[8.7.0.03,8.012,16]heptadeca-3,6-diene-2,5,11-trione;9-[(11S)-7,8-difluoro-6,11-dihydrobenzo[c][1]benzothiepin-11-yl]-4-phenylmethoxy-1,8,9,12-tetrazatetracyclo[8.7.0.03,8.012,16]heptadeca-3,6-diene-2,5,11-trione;ethyl 3-[[1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidin-2-yl]methyl]-4,6-dioxo-5-phenylmethoxy-1,2-dihydropyrido[2,1-f][1,2,4]triazine-2-carboxylate;methane;4-phenylmethoxy-1,8,9,12-tetrazatetracyclo[8.7.0.03,8.012,16]heptadeca-3,6-diene-2,5,11-trione

tert-butyl 2-(aminomethyl)pyrrolidine-1-carboxylate;tert-butyl 2-[[(1-amino-4-oxo-3-phenylmethoxypyridine-2-carbonyl)amino]methyl]pyrrolidine-1-carboxylate;9-[(11S)-7,8-difluoro-6,11-dihydrobenzo[c][1]benzothiepin-11-yl]-4-hydroxy-1,8,9,12-tetrazatetracyclo[8.7.0.03,8.012,16]heptadeca-3,6-diene-2,5,11-trione;9-[(11S)-7,8-difluoro-6,11-dihydrobenzo[c][1]benzothiepin-11-yl]-4-phenylmethoxy-1,8,9,12-tetrazatetracyclo[8.7.0.03,8.012,16]heptadeca-3,6-diene-2,5,11-trione;ethyl 3-[[1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidin-2-yl]methyl]-4,6-dioxo-5-phenylmethoxy-1,2-dihydropyrido[2,1-f][1,2,4]triazine-2-carboxylate;methane;4-phenylmethoxy-1,8,9,12-tetrazatetracyclo[8.7.0.03,8.012,16]heptadeca-3,6-diene-2,5,11-trione (PubChem CID 158482682) has the molecular formula C143H162F4N22O26S2 and a molecular weight of 2745.12 g/mol. Its IUPAC name is tert-butyl 2-(aminomethyl)pyrrolidine-1-carboxylate;tert-butyl 2-[[(1-amino-4-oxo-3-phenylmethoxypyridine-2-carbonyl)amino]methyl]pyrrolidine-1-carboxylate;9-[(11S)-7,8-difluoro-6,11-dihydrobenzo[c][1]benzothiepin-11-yl]-4-hydroxy-1,8,9,12-tetrazatetracyclo[8.7.0.03,8.012,16]heptadeca-3,6-diene-2,5,11-trione;9-[(11S)-7,8-difluoro-6,11-dihydrobenzo[c][1]benzothiepin-11-yl]-4-phenylmethoxy-1,8,9,12-tetrazatetracyclo[8.7.0.03,8.012,16]heptadeca-3,6-diene-2,5,11-trione;ethyl 3-[[1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidin-2-yl]methyl]-4,6-dioxo-5-phenylmethoxy-1,2-dihydropyrido[2,1-f][1,2,4]triazine-2-carboxylate;methane;4-phenylmethoxy-1,8,9,12-tetrazatetracyclo[8.7.0.03,8.012,16]heptadeca-3,6-diene-2,5,11-trione.

Molecular Properties

• Compound Name: tert-butyl 2-(aminomethyl)pyrrolidine-1-carboxylate;tert-butyl 2-[[(1-amino-4-oxo-3-phenylmethoxypyridine-2-carbonyl)amino]methyl]pyrrolidine-1-carboxylate;9-[(11S)-7,8-difluoro-6,11-dihydrobenzo[c][1]benzothiepin-11-yl]-4-hydroxy-1,8,9,12-tetrazatetracyclo[8.7.0.03,8.012,16]heptadeca-3,6-diene-2,5,11-trione;9-[(11S)-7,8-difluoro-6,11-dihydrobenzo[c][1]benzothiepin-11-yl]-4-phenylmethoxy-1,8,9,12-tetrazatetracyclo[8.7.0.03,8.012,16]heptadeca-3,6-diene-2,5,11-trione;ethyl 3-[[1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidin-2-yl]methyl]-4,6-dioxo-5-phenylmethoxy-1,2-dihydropyrido[2,1-f][1,2,4]triazine-2-carboxylate;methane;4-phenylmethoxy-1,8,9,12-tetrazatetracyclo[8.7.0.03,8.012,16]heptadeca-3,6-diene-2,5,11-trione
• PubChem CID: 158482682
• Molecular Formula: C143H162F4N22O26S2
• Molecular Weight: 2745.12 g/mol
• Exact Mass: 2743.14
• IUPAC Name: tert-butyl 2-(aminomethyl)pyrrolidine-1-carboxylate;tert-butyl 2-[[(1-amino-4-oxo-3-phenylmethoxypyridine-2-carbonyl)amino]methyl]pyrrolidine-1-carboxylate;9-[(11S)-7,8-difluoro-6,11-dihydrobenzo[c][1]benzothiepin-11-yl]-4-hydroxy-1,8,9,12-tetrazatetracyclo[8.7.0.03,8.012,16]heptadeca-3,6-diene-2,5,11-trione;9-[(11S)-7,8-difluoro-6,11-dihydrobenzo[c][1]benzothiepin-11-yl]-4-phenylmethoxy-1,8,9,12-tetrazatetracyclo[8.7.0.03,8.012,16]heptadeca-3,6-diene-2,5,11-trione;ethyl 3-[[1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidin-2-yl]methyl]-4,6-dioxo-5-phenylmethoxy-1,2-dihydropyrido[2,1-f][1,2,4]triazine-2-carboxylate;methane;4-phenylmethoxy-1,8,9,12-tetrazatetracyclo[8.7.0.03,8.012,16]heptadeca-3,6-diene-2,5,11-trione
• SMILES: C.C.CC(C)(C)OC(=O)N1CCCC1CN.CC(C)(C)OC(=O)N1CCCC1CNC(=O)c1c(OCc2ccccc2)c(=O)ccn1N.CCOC(=O)C1Nn2ccc(=O)c(OCc3ccccc3)c2C(=O)N1CC1CCCN1C(=O)OC(C)(C)C.O=C1C2N(CC3CCCN13)C(=O)c1c(O)c(=O)ccn1N2[C@@H]1c2ccccc2SCc2c1ccc(F)c2F.O=C1C2N(CC3CCCN13)C(=O)c1c(OCc3ccccc3)c(=O)ccn1N2[C@@H]1c2ccccc2SCc2c1ccc(F)c2F.O=C1C2Nn3ccc(=O)c(OCc4ccccc4)c3C(=O)N2CC2CCCN12
• InChI: InChI=1S/C34H28F2N4O4S.C27H22F2N4O4S.C27H34N4O7.C23H30N4O5.C20H20N4O4.C10H20N2O2.2CH4/c35-25-13-12-22-24(28(25)36)19-45-27-11-5-4-10-23(27)29(22)40-32-34(43)37-15-6-9-21(37)17-38(32)33(42)30-31(26(41)14-16-39(30)40)44-18-20-7-2-1-3-8-20;28-18-8-7-15-17(21(18)29)13-38-20-6-2-1-5-16(20)22(15)33-25-27(37)30-10-3-4-14(30)12-31(25)26(36)23-24(35)19(34)9-11-32(23)33;1-5-36-25(34)23-28-31-15-13-20(32)22(37-17-18-10-7-6-8-11-18)21(31)24(33)30(23)16-19-12-9-14-29(19)26(35)38-27(2,3)4;1-23(2,3)32-22(30)26-12-7-10-17(26)14-25-21(29)19-20(18(28)11-13-27(19)24)31-15-16-8-5-4-6-9-16;25-15-8-10-24-16(17(15)28-12-13-5-2-1-3-6-13)19(26)23-11-14-7-4-9-22(14)20(27)18(23)21-24;1-10(2,3)14-9(13)12-6-4-5-8(12)7-11;;/h1-5,7-8,10-14,16,21,29,32H,6,9,15,17-19H2;1-2,5-9,11,14,22,25,35H,3-4,10,12-13H2;6-8,10-11,13,15,19,23,28H,5,9,12,14,16-17H2,1-4H3;4-6,8-9,11,13,17H,7,10,12,14-15,24H2,1-3H3,(H,25,29);1-3,5-6,8,10,14,18,21H,4,7,9,11-12H2;8H,4-7,11H2,1-3H3;2*1H4/t21?,29-,32?;14?,22-,25?;;;;;;/m00....../s1
• InChIKey: HHSDAVMDEVZAET-SNZPSWOOSA-N
• XLogP: 16.14
• TPSA: 535.92 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 39
• Rotatable Bonds: 22
• Heavy Atoms: 197
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2745.12
LogP ≤ 5	16.14
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	39

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of tert-butyl 2-(aminomethyl)pyrrolidine-1-carboxylate;tert-butyl 2-[[(1-amino-4-oxo-3-phenylmethoxypyridine-2-carbonyl)amino]methyl]pyrrolidine-1-carboxylate;9-[(11S)-7,8-difluoro-6,11-dihydrobenzo[c][1]benzothiepin-11-yl]-4-hydroxy-1,8,9,12-tetrazatetracyclo[8.7.0.03,8.012,16]heptadeca-3,6-diene-2,5,11-trione;9-[(11S)-7,8-difluoro-6,11-dihydrobenzo[c][1]benzothiepin-11-yl]-4-phenylmethoxy-1,8,9,12-tetrazatetracyclo[8.7.0.03,8.012,16]heptadeca-3,6-diene-2,5,11-trione;ethyl 3-[[1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidin-2-yl]methyl]-4,6-dioxo-5-phenylmethoxy-1,2-dihydropyrido[2,1-f][1,2,4]triazine-2-carboxylate;methane;4-phenylmethoxy-1,8,9,12-tetrazatetracyclo[8.7.0.03,8.012,16]heptadeca-3,6-diene-2,5,11-trione?

The IUPAC name of tert-butyl 2-(aminomethyl)pyrrolidine-1-carboxylate;tert-butyl 2-[[(1-amino-4-oxo-3-phenylmethoxypyridine-2-carbonyl)amino]methyl]pyrrolidine-1-carboxylate;9-[(11S)-7,8-difluoro-6,11-dihydrobenzo[c][1]benzothiepin-11-yl]-4-hydroxy-1,8,9,12-tetrazatetracyclo[8.7.0.03,8.012,16]heptadeca-3,6-diene-2,5,11-trione;9-[(11S)-7,8-difluoro-6,11-dihydrobenzo[c][1]benzothiepin-11-yl]-4-phenylmethoxy-1,8,9,12-tetrazatetracyclo[8.7.0.03,8.012,16]heptadeca-3,6-diene-2,5,11-trione;ethyl 3-[[1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidin-2-yl]methyl]-4,6-dioxo-5-phenylmethoxy-1,2-dihydropyrido[2,1-f][1,2,4]triazine-2-carboxylate;methane;4-phenylmethoxy-1,8,9,12-tetrazatetracyclo[8.7.0.03,8.012,16]heptadeca-3,6-diene-2,5,11-trione (CID 158482682) is tert-butyl 2-(aminomethyl)pyrrolidine-1-carboxylate;tert-butyl 2-[[(1-amino-4-oxo-3-phenylmethoxypyridine-2-carbonyl)amino]methyl]pyrrolidine-1-carboxylate;9-[(11S)-7,8-difluoro-6,11-dihydrobenzo[c][1]benzothiepin-11-yl]-4-hydroxy-1,8,9,12-tetrazatetracyclo[8.7.0.03,8.012,16]heptadeca-3,6-diene-2,5,11-trione;9-[(11S)-7,8-difluoro-6,11-dihydrobenzo[c][1]benzothiepin-11-yl]-4-phenylmethoxy-1,8,9,12-tetrazatetracyclo[8.7.0.03,8.012,16]heptadeca-3,6-diene-2,5,11-trione;ethyl 3-[[1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidin-2-yl]methyl]-4,6-dioxo-5-phenylmethoxy-1,2-dihydropyrido[2,1-f][1,2,4]triazine-2-carboxylate;methane;4-phenylmethoxy-1,8,9,12-tetrazatetracyclo[8.7.0.03,8.012,16]heptadeca-3,6-diene-2,5,11-trione.

What is the SMILES notation for tert-butyl 2-(aminomethyl)pyrrolidine-1-carboxylate;tert-butyl 2-[[(1-amino-4-oxo-3-phenylmethoxypyridine-2-carbonyl)amino]methyl]pyrrolidine-1-carboxylate;9-[(11S)-7,8-difluoro-6,11-dihydrobenzo[c][1]benzothiepin-11-yl]-4-hydroxy-1,8,9,12-tetrazatetracyclo[8.7.0.03,8.012,16]heptadeca-3,6-diene-2,5,11-trione;9-[(11S)-7,8-difluoro-6,11-dihydrobenzo[c][1]benzothiepin-11-yl]-4-phenylmethoxy-1,8,9,12-tetrazatetracyclo[8.7.0.03,8.012,16]heptadeca-3,6-diene-2,5,11-trione;ethyl 3-[[1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidin-2-yl]methyl]-4,6-dioxo-5-phenylmethoxy-1,2-dihydropyrido[2,1-f][1,2,4]triazine-2-carboxylate;methane;4-phenylmethoxy-1,8,9,12-tetrazatetracyclo[8.7.0.03,8.012,16]heptadeca-3,6-diene-2,5,11-trione?

The canonical SMILES for tert-butyl 2-(aminomethyl)pyrrolidine-1-carboxylate;tert-butyl 2-[[(1-amino-4-oxo-3-phenylmethoxypyridine-2-carbonyl)amino]methyl]pyrrolidine-1-carboxylate;9-[(11S)-7,8-difluoro-6,11-dihydrobenzo[c][1]benzothiepin-11-yl]-4-hydroxy-1,8,9,12-tetrazatetracyclo[8.7.0.03,8.012,16]heptadeca-3,6-diene-2,5,11-trione;9-[(11S)-7,8-difluoro-6,11-dihydrobenzo[c][1]benzothiepin-11-yl]-4-phenylmethoxy-1,8,9,12-tetrazatetracyclo[8.7.0.03,8.012,16]heptadeca-3,6-diene-2,5,11-trione;ethyl 3-[[1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidin-2-yl]methyl]-4,6-dioxo-5-phenylmethoxy-1,2-dihydropyrido[2,1-f][1,2,4]triazine-2-carboxylate;methane;4-phenylmethoxy-1,8,9,12-tetrazatetracyclo[8.7.0.03,8.012,16]heptadeca-3,6-diene-2,5,11-trione is C.C.CC(C)(C)OC(=O)N1CCCC1CN.CC(C)(C)OC(=O)N1CCCC1CNC(=O)c1c(OCc2ccccc2)c(=O)ccn1N.CCOC(=O)C1Nn2ccc(=O)c(OCc3ccccc3)c2C(=O)N1CC1CCCN1C(=O)OC(C)(C)C.O=C1C2N(CC3CCCN13)C(=O)c1c(O)c(=O)ccn1N2[C@@H]1c2ccccc2SCc2c1ccc(F)c2F.O=C1C2N(CC3CCCN13)C(=O)c1c(OCc3ccccc3)c(=O)ccn1N2[C@@H]1c2ccccc2SCc2c1ccc(F)c2F.O=C1C2Nn3ccc(=O)c(OCc4ccccc4)c3C(=O)N2CC2CCCN12.

What is the InChIKey of tert-butyl 2-(aminomethyl)pyrrolidine-1-carboxylate;tert-butyl 2-[[(1-amino-4-oxo-3-phenylmethoxypyridine-2-carbonyl)amino]methyl]pyrrolidine-1-carboxylate;9-[(11S)-7,8-difluoro-6,11-dihydrobenzo[c][1]benzothiepin-11-yl]-4-hydroxy-1,8,9,12-tetrazatetracyclo[8.7.0.03,8.012,16]heptadeca-3,6-diene-2,5,11-trione;9-[(11S)-7,8-difluoro-6,11-dihydrobenzo[c][1]benzothiepin-11-yl]-4-phenylmethoxy-1,8,9,12-tetrazatetracyclo[8.7.0.03,8.012,16]heptadeca-3,6-diene-2,5,11-trione;ethyl 3-[[1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidin-2-yl]methyl]-4,6-dioxo-5-phenylmethoxy-1,2-dihydropyrido[2,1-f][1,2,4]triazine-2-carboxylate;methane;4-phenylmethoxy-1,8,9,12-tetrazatetracyclo[8.7.0.03,8.012,16]heptadeca-3,6-diene-2,5,11-trione?

The InChIKey is HHSDAVMDEVZAET-SNZPSWOOSA-N. The full InChI is InChI=1S/C34H28F2N4O4S.C27H22F2N4O4S.C27H34N4O7.C23H30N4O5.C20H20N4O4.C10H20N2O2.2CH4/c35-25-13-12-22-24(28(25)36)19-45-27-11-5-4-10-23(27)29(22)40-32-34(43)37-15-6-9-21(37)17-38(32)33(42)30-31(26(41)14-16-39(30)40)44-18-20-7-2-1-3-8-20;28-18-8-7-15-17(21(18)29)13-38-20-6-2-1-5-16(20)22(15)33-25-27(37)30-10-3-4-14(30)12-31(25)26(36)23-24(35)19(34)9-11-32(23)33;1-5-36-25(34)23-28-31-15-13-20(32)22(37-17-18-10-7-6-8-11-18)21(31)24(33)30(23)16-19-12-9-14-29(19)26(35)38-27(2,3)4;1-23(2,3)32-22(30)26-12-7-10-17(26)14-25-21(29)19-20(18(28)11-13-27(19)24)31-15-16-8-5-4-6-9-16;25-15-8-10-24-16(17(15)28-12-13-5-2-1-3-6-13)19(26)23-11-14-7-4-9-22(14)20(27)18(23)21-24;1-10(2,3)14-9(13)12-6-4-5-8(12)7-11;;/h1-5,7-8,10-14,16,21,29,32H,6,9,15,17-19H2;1-2,5-9,11,14,22,25,35H,3-4,10,12-13H2;6-8,10-11,13,15,19,23,28H,5,9,12,14,16-17H2,1-4H3;4-6,8-9,11,13,17H,7,10,12,14-15,24H2,1-3H3,(H,25,29);1-3,5-6,8,10,14,18,21H,4,7,9,11-12H2;8H,4-7,11H2,1-3H3;2*1H4/t21?,29-,32?;14?,22-,25?;;;;;;/m00....../s1.

What are the key properties of tert-butyl 2-(aminomethyl)pyrrolidine-1-carboxylate;tert-butyl 2-[[(1-amino-4-oxo-3-phenylmethoxypyridine-2-carbonyl)amino]methyl]pyrrolidine-1-carboxylate;9-[(11S)-7,8-difluoro-6,11-dihydrobenzo[c][1]benzothiepin-11-yl]-4-hydroxy-1,8,9,12-tetrazatetracyclo[8.7.0.03,8.012,16]heptadeca-3,6-diene-2,5,11-trione;9-[(11S)-7,8-difluoro-6,11-dihydrobenzo[c][1]benzothiepin-11-yl]-4-phenylmethoxy-1,8,9,12-tetrazatetracyclo[8.7.0.03,8.012,16]heptadeca-3,6-diene-2,5,11-trione;ethyl 3-[[1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidin-2-yl]methyl]-4,6-dioxo-5-phenylmethoxy-1,2-dihydropyrido[2,1-f][1,2,4]triazine-2-carboxylate;methane;4-phenylmethoxy-1,8,9,12-tetrazatetracyclo[8.7.0.03,8.012,16]heptadeca-3,6-diene-2,5,11-trione?

tert-butyl 2-(aminomethyl)pyrrolidine-1-carboxylate;tert-butyl 2-[[(1-amino-4-oxo-3-phenylmethoxypyridine-2-carbonyl)amino]methyl]pyrrolidine-1-carboxylate;9-[(11S)-7,8-difluoro-6,11-dihydrobenzo[c][1]benzothiepin-11-yl]-4-hydroxy-1,8,9,12-tetrazatetracyclo[8.7.0.03,8.012,16]heptadeca-3,6-diene-2,5,11-trione;9-[(11S)-7,8-difluoro-6,11-dihydrobenzo[c][1]benzothiepin-11-yl]-4-phenylmethoxy-1,8,9,12-tetrazatetracyclo[8.7.0.03,8.012,16]heptadeca-3,6-diene-2,5,11-trione;ethyl 3-[[1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidin-2-yl]methyl]-4,6-dioxo-5-phenylmethoxy-1,2-dihydropyrido[2,1-f][1,2,4]triazine-2-carboxylate;methane;4-phenylmethoxy-1,8,9,12-tetrazatetracyclo[8.7.0.03,8.012,16]heptadeca-3,6-diene-2,5,11-trione has a molecular weight of 2745.12 g/mol, XLogP of 16.14, 22 rotatable bonds, 6 hydrogen bond donors, and 39 hydrogen bond acceptors.

Where does this data come from?

All data for tert-butyl 2-(aminomethyl)pyrrolidine-1-carboxylate;tert-butyl 2-[[(1-amino-4-oxo-3-phenylmethoxypyridine-2-carbonyl)amino]methyl]pyrrolidine-1-carboxylate;9-[(11S)-7,8-difluoro-6,11-dihydrobenzo[c][1]benzothiepin-11-yl]-4-hydroxy-1,8,9,12-tetrazatetracyclo[8.7.0.03,8.012,16]heptadeca-3,6-diene-2,5,11-trione;9-[(11S)-7,8-difluoro-6,11-dihydrobenzo[c][1]benzothiepin-11-yl]-4-phenylmethoxy-1,8,9,12-tetrazatetracyclo[8.7.0.03,8.012,16]heptadeca-3,6-diene-2,5,11-trione;ethyl 3-[[1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidin-2-yl]methyl]-4,6-dioxo-5-phenylmethoxy-1,2-dihydropyrido[2,1-f][1,2,4]triazine-2-carboxylate;methane;4-phenylmethoxy-1,8,9,12-tetrazatetracyclo[8.7.0.03,8.012,16]heptadeca-3,6-diene-2,5,11-trione is sourced from PubChem (CID 158482682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).