N-(2-acetamidoethyl)-5-[(4-tert-butylphenyl)sulfonylamino]-3-(3-methylphenyl)-1H-indole-2-carboxamide

Systemtic Name: N-(2-acetamidoethyl)-5-[(4-tert-butylphenyl)sulfonylamino]-3-(3-methylphenyl)-1H-indole-2-carboxamide Openeye Name: N-(2-acetamidoethyl)-5-[(4-tert-butylphenyl)sulfonylamino]-3-(m-tolyl)-1H-indole-2-carboxamide CAS Name: N-(2-acetamidoethyl)-5-[(4-tert-butylphenyl)sulfonylamino]-3-(3-methylphenyl)-1H-indole-2-carboxamide IUPAC Name: N-(2-acetamidoethyl)-5-[(4-tert-butylphenyl)sulfonylamino]-3-(3-methylphenyl)-1H-indole-2-carboxamide Traditional Name: N-(2-acetamidoethyl)-5-[(4-tert-butylphenyl)sulfonylamino]-3-(m-tolyl)-1H-indole-2-carboxamide Formula: C30H34N4O4S MolecularWeight: 546.68036

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=C(NC3=C2C=C(C=C3)NS(=O)(=O)C4=CC=C(C=C4)C(C)(C)C)C(=O)NCCNC(=O)C

Isomeric SMILES

CC1=CC=CC(=C1)C2=C(NC3=C2C=C(C=C3)NS(=O)(=O)C4=CC=C(C=C4)C(C)(C)C)C(=O)NCCNC(=O)C

InChI

InChI=1S/C30H34N4O4S/c1-19-7-6-8-21(17-19)27-25-18-23(34-39(37,38)24-12-9-22(10-13-24)30(3,4)5)11-14-26(25)33-28(27)29(36)32-16-15-31-20(2)35/h6-14,17-18,33-34H,15-16H2,1-5H3,(H,31,35)(H,32,36)