4-[[5-(cyclopentylcarbonylamino)-1-(diphenylmethyl)indol-3-yl]carbonylamino]thiophene-3-carboxylic acid

Systemtic Name: 4-[[5-(cyclopentylcarbonylamino)-1-(diphenylmethyl)indol-3-yl]carbonylamino]thiophene-3-carboxylic acid Openeye Name: 4-[[1-benzhydryl-5-(cyclopentanecarbonylamino)indole-3-carbonyl]amino]thiophene-3-carboxylic acid CAS Name: 4-[[[5-[[cyclopentyl(oxo)methyl]amino]-1-(diphenylmethyl)-3-indolyl]-oxomethyl]amino]-3-thiophenecarboxylic acid IUPAC Name: 4-[[1-benzhydryl-5-(cyclopentanecarbonylamino)indole-3-carbonyl]amino]thiophene-3-carboxylic acid Traditional Name: 4-[[1-benzhydryl-5-(cyclopentanecarbonylamino)indole-3-carbonyl]amino]-3-thenoic acid Formula: C33H29N3O4S MolecularWeight: 563.66606

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)C(=O)NC2=CC3=C(C=C2)N(C=C3C(=O)NC4=CSC=C4C(=O)O)C(C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

C1CCC(C1)C(=O)NC2=CC3=C(C=C2)N(C=C3C(=O)NC4=CSC=C4C(=O)O)C(C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C33H29N3O4S/c37-31(23-13-7-8-14-23)34-24-15-16-29-25(17-24)26(32(38)35-28-20-41-19-27(28)33(39)40)18-36(29)30(21-9-3-1-4-10-21)22-11-5-2-6-12-22/h1-6,9-12,15-20,23,30H,7-8,13-14H2,(H,34,37)(H,35,38)(H,39,40)