N-[4-[3-cyano-1-cyclobutyl-6-(1H-1,2,4-triazol-5-ylmethoxy)indol-2-yl]phenyl]cyclopropanesulfonamide;1-cyclobutyl-3-[4-(1-cyclobutyl-6-ethoxyindol-2-yl)phenyl]urea;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(2-methyl-1,3-thiazol-4-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(2H-tetrazol-5-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(1,3-thiazol-4-yl)indol-2-yl]phenyl]carbamate

C136H147N21O14S3 — CID 157478665

About N-[4-[3-cyano-1-cyclobutyl-6-(1H-1,2,4-triazol-5-ylmethoxy)indol-2-yl]phenyl]cyclopropanesulfonamide;1-cyclobutyl-3-[4-(1-cyclobutyl-6-ethoxyindol-2-yl)phenyl]urea;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(2-methyl-1,3-thiazol-4-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(2H-tetrazol-5-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(1,3-thiazol-4-yl)indol-2-yl]phenyl]carbamate

N-[4-[3-cyano-1-cyclobutyl-6-(1H-1,2,4-triazol-5-ylmethoxy)indol-2-yl]phenyl]cyclopropanesulfonamide;1-cyclobutyl-3-[4-(1-cyclobutyl-6-ethoxyindol-2-yl)phenyl]urea;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(2-methyl-1,3-thiazol-4-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(2H-tetrazol-5-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(1,3-thiazol-4-yl)indol-2-yl]phenyl]carbamate (PubChem CID 157478665) has the molecular formula C136H147N21O14S3 and a molecular weight of 2396.01 g/mol. Its IUPAC name is N-[4-[3-cyano-1-cyclobutyl-6-(1H-1,2,4-triazol-5-ylmethoxy)indol-2-yl]phenyl]cyclopropanesulfonamide;1-cyclobutyl-3-[4-(1-cyclobutyl-6-ethoxyindol-2-yl)phenyl]urea;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(2-methyl-1,3-thiazol-4-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(2H-tetrazol-5-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(1,3-thiazol-4-yl)indol-2-yl]phenyl]carbamate.

Molecular Properties

• Compound Name: N-[4-[3-cyano-1-cyclobutyl-6-(1H-1,2,4-triazol-5-ylmethoxy)indol-2-yl]phenyl]cyclopropanesulfonamide;1-cyclobutyl-3-[4-(1-cyclobutyl-6-ethoxyindol-2-yl)phenyl]urea;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(2-methyl-1,3-thiazol-4-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(2H-tetrazol-5-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(1,3-thiazol-4-yl)indol-2-yl]phenyl]carbamate
• PubChem CID: 157478665
• Molecular Formula: C136H147N21O14S3
• Molecular Weight: 2396.01 g/mol
• Exact Mass: 2394.06
• IUPAC Name: N-[4-[3-cyano-1-cyclobutyl-6-(1H-1,2,4-triazol-5-ylmethoxy)indol-2-yl]phenyl]cyclopropanesulfonamide;1-cyclobutyl-3-[4-(1-cyclobutyl-6-ethoxyindol-2-yl)phenyl]urea;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(2-methyl-1,3-thiazol-4-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(2H-tetrazol-5-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(1,3-thiazol-4-yl)indol-2-yl]phenyl]carbamate
• SMILES: CCOc1ccc2c(-c3csc(C)n3)c(-c3ccc(NC(=O)OC(C)C4CC4)cc3)n(C3CCC3)c2c1.CCOc1ccc2c(-c3cscn3)c(-c3ccc(NC(=O)OC(C)C4CC4)cc3)n(C3CCC3)c2c1.CCOc1ccc2c(-c3nn[nH]n3)c(-c3ccc(NC(=O)OC(C)C4CC4)cc3)n(C3CCC3)c2c1.CCOc1ccc2cc(-c3ccc(NC(=O)NC4CCC4)cc3)n(C3CCC3)c2c1.N#Cc1c(-c2ccc(NS(=O)(=O)C3CC3)cc2)n(C2CCC2)c2cc(OCc3ncn[nH]3)ccc12
• InChI: InChI=1S/C30H33N3O3S.C29H31N3O3S.C27H30N6O3.C25H24N6O3S.C25H29N3O2/c1-4-35-24-14-15-25-27(16-24)33(23-6-5-7-23)29(28(25)26-17-37-19(3)31-26)21-10-12-22(13-11-21)32-30(34)36-18(2)20-8-9-20;1-3-34-23-13-14-24-26(15-23)32(22-5-4-6-22)28(27(24)25-16-36-17-30-25)20-9-11-21(12-10-20)31-29(33)35-18(2)19-7-8-19;1-3-35-21-13-14-22-23(15-21)33(20-5-4-6-20)25(24(22)26-29-31-32-30-26)18-9-11-19(12-10-18)28-27(34)36-16(2)17-7-8-17;26-13-22-21-11-8-19(34-14-24-27-15-28-29-24)12-23(21)31(18-2-1-3-18)25(22)16-4-6-17(7-5-16)30-35(32,33)20-9-10-20;1-2-30-22-14-11-18-15-23(28(24(18)16-22)21-7-4-8-21)17-9-12-20(13-10-17)27-25(29)26-19-5-3-6-19/h10-18,20,23H,4-9H2,1-3H3,(H,32,34);9-19,22H,3-8H2,1-2H3,(H,31,33);9-17,20H,3-8H2,1-2H3,(H,28,34)(H,29,30,31,32);4-8,11-12,15,18,20,30H,1-3,9-10,14H2,(H,27,28,29);9-16,19,21H,2-8H2,1H3,(H2,26,27,29)
• InChIKey: BVWZUNWLNCIENM-UHFFFAOYSA-N
• XLogP: 32.68
• TPSA: 418.69 Ų
• H-Bond Donors: 8
• H-Bond Acceptors: 29
• Rotatable Bonds: 38
• Heavy Atoms: 174
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2396.01
LogP ≤ 5	32.68
H-Bond Donors ≤ 5	8
H-Bond Acceptors ≤ 10	29

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of N-[4-[3-cyano-1-cyclobutyl-6-(1H-1,2,4-triazol-5-ylmethoxy)indol-2-yl]phenyl]cyclopropanesulfonamide;1-cyclobutyl-3-[4-(1-cyclobutyl-6-ethoxyindol-2-yl)phenyl]urea;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(2-methyl-1,3-thiazol-4-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(2H-tetrazol-5-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(1,3-thiazol-4-yl)indol-2-yl]phenyl]carbamate?

The IUPAC name of N-[4-[3-cyano-1-cyclobutyl-6-(1H-1,2,4-triazol-5-ylmethoxy)indol-2-yl]phenyl]cyclopropanesulfonamide;1-cyclobutyl-3-[4-(1-cyclobutyl-6-ethoxyindol-2-yl)phenyl]urea;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(2-methyl-1,3-thiazol-4-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(2H-tetrazol-5-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(1,3-thiazol-4-yl)indol-2-yl]phenyl]carbamate (CID 157478665) is N-[4-[3-cyano-1-cyclobutyl-6-(1H-1,2,4-triazol-5-ylmethoxy)indol-2-yl]phenyl]cyclopropanesulfonamide;1-cyclobutyl-3-[4-(1-cyclobutyl-6-ethoxyindol-2-yl)phenyl]urea;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(2-methyl-1,3-thiazol-4-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(2H-tetrazol-5-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(1,3-thiazol-4-yl)indol-2-yl]phenyl]carbamate.

What is the SMILES notation for N-[4-[3-cyano-1-cyclobutyl-6-(1H-1,2,4-triazol-5-ylmethoxy)indol-2-yl]phenyl]cyclopropanesulfonamide;1-cyclobutyl-3-[4-(1-cyclobutyl-6-ethoxyindol-2-yl)phenyl]urea;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(2-methyl-1,3-thiazol-4-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(2H-tetrazol-5-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(1,3-thiazol-4-yl)indol-2-yl]phenyl]carbamate?

The canonical SMILES for N-[4-[3-cyano-1-cyclobutyl-6-(1H-1,2,4-triazol-5-ylmethoxy)indol-2-yl]phenyl]cyclopropanesulfonamide;1-cyclobutyl-3-[4-(1-cyclobutyl-6-ethoxyindol-2-yl)phenyl]urea;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(2-methyl-1,3-thiazol-4-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(2H-tetrazol-5-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(1,3-thiazol-4-yl)indol-2-yl]phenyl]carbamate is CCOc1ccc2c(-c3csc(C)n3)c(-c3ccc(NC(=O)OC(C)C4CC4)cc3)n(C3CCC3)c2c1.CCOc1ccc2c(-c3cscn3)c(-c3ccc(NC(=O)OC(C)C4CC4)cc3)n(C3CCC3)c2c1.CCOc1ccc2c(-c3nn[nH]n3)c(-c3ccc(NC(=O)OC(C)C4CC4)cc3)n(C3CCC3)c2c1.CCOc1ccc2cc(-c3ccc(NC(=O)NC4CCC4)cc3)n(C3CCC3)c2c1.N#Cc1c(-c2ccc(NS(=O)(=O)C3CC3)cc2)n(C2CCC2)c2cc(OCc3ncn[nH]3)ccc12.

What is the InChIKey of N-[4-[3-cyano-1-cyclobutyl-6-(1H-1,2,4-triazol-5-ylmethoxy)indol-2-yl]phenyl]cyclopropanesulfonamide;1-cyclobutyl-3-[4-(1-cyclobutyl-6-ethoxyindol-2-yl)phenyl]urea;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(2-methyl-1,3-thiazol-4-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(2H-tetrazol-5-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(1,3-thiazol-4-yl)indol-2-yl]phenyl]carbamate?

The InChIKey is BVWZUNWLNCIENM-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H33N3O3S.C29H31N3O3S.C27H30N6O3.C25H24N6O3S.C25H29N3O2/c1-4-35-24-14-15-25-27(16-24)33(23-6-5-7-23)29(28(25)26-17-37-19(3)31-26)21-10-12-22(13-11-21)32-30(34)36-18(2)20-8-9-20;1-3-34-23-13-14-24-26(15-23)32(22-5-4-6-22)28(27(24)25-16-36-17-30-25)20-9-11-21(12-10-20)31-29(33)35-18(2)19-7-8-19;1-3-35-21-13-14-22-23(15-21)33(20-5-4-6-20)25(24(22)26-29-31-32-30-26)18-9-11-19(12-10-18)28-27(34)36-16(2)17-7-8-17;26-13-22-21-11-8-19(34-14-24-27-15-28-29-24)12-23(21)31(18-2-1-3-18)25(22)16-4-6-17(7-5-16)30-35(32,33)20-9-10-20;1-2-30-22-14-11-18-15-23(28(24(18)16-22)21-7-4-8-21)17-9-12-20(13-10-17)27-25(29)26-19-5-3-6-19/h10-18,20,23H,4-9H2,1-3H3,(H,32,34);9-19,22H,3-8H2,1-2H3,(H,31,33);9-17,20H,3-8H2,1-2H3,(H,28,34)(H,29,30,31,32);4-8,11-12,15,18,20,30H,1-3,9-10,14H2,(H,27,28,29);9-16,19,21H,2-8H2,1H3,(H2,26,27,29).

What are the key properties of N-[4-[3-cyano-1-cyclobutyl-6-(1H-1,2,4-triazol-5-ylmethoxy)indol-2-yl]phenyl]cyclopropanesulfonamide;1-cyclobutyl-3-[4-(1-cyclobutyl-6-ethoxyindol-2-yl)phenyl]urea;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(2-methyl-1,3-thiazol-4-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(2H-tetrazol-5-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(1,3-thiazol-4-yl)indol-2-yl]phenyl]carbamate?

N-[4-[3-cyano-1-cyclobutyl-6-(1H-1,2,4-triazol-5-ylmethoxy)indol-2-yl]phenyl]cyclopropanesulfonamide;1-cyclobutyl-3-[4-(1-cyclobutyl-6-ethoxyindol-2-yl)phenyl]urea;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(2-methyl-1,3-thiazol-4-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(2H-tetrazol-5-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(1,3-thiazol-4-yl)indol-2-yl]phenyl]carbamate has a molecular weight of 2396.01 g/mol, XLogP of 32.68, 38 rotatable bonds, 8 hydrogen bond donors, and 29 hydrogen bond acceptors.

Where does this data come from?

All data for N-[4-[3-cyano-1-cyclobutyl-6-(1H-1,2,4-triazol-5-ylmethoxy)indol-2-yl]phenyl]cyclopropanesulfonamide;1-cyclobutyl-3-[4-(1-cyclobutyl-6-ethoxyindol-2-yl)phenyl]urea;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(2-methyl-1,3-thiazol-4-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(2H-tetrazol-5-yl)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-(1,3-thiazol-4-yl)indol-2-yl]phenyl]carbamate is sourced from PubChem (CID 157478665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).