4-(1-ethylindol-5-yl)sulfonyl-N-(4-methylphenyl)-1,4-diazepane-1-carboxamide

Systemtic Name: 4-(1-ethylindol-5-yl)sulfonyl-N-(4-methylphenyl)-1,4-diazepane-1-carboxamide Openeye Name: 4-(1-ethylindol-5-yl)sulfonyl-N-(p-tolyl)-1,4-diazepane-1-carboxamide CAS Name: 4-[(1-ethyl-5-indolyl)sulfonyl]-N-(4-methylphenyl)-1,4-diazepane-1-carboxamide IUPAC Name: 4-(1-ethylindol-5-yl)sulfonyl-N-(4-methylphenyl)-1,4-diazepane-1-carboxamide Traditional Name: 4-(1-ethylindol-5-yl)sulfonyl-N-(p-tolyl)-1,4-diazepane-1-carboxamide Formula: C23H28N4O3S MolecularWeight: 440.55842

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=CC2=C1C=CC(=C2)S(=O)(=O)N3CCCN(CC3)C(=O)NC4=CC=C(C=C4)C

Isomeric SMILES

CCN1C=CC2=C1C=CC(=C2)S(=O)(=O)N3CCCN(CC3)C(=O)NC4=CC=C(C=C4)C

InChI

InChI=1S/C23H28N4O3S/c1-3-25-14-11-19-17-21(9-10-22(19)25)31(29,30)27-13-4-12-26(15-16-27)23(28)24-20-7-5-18(2)6-8-20/h5-11,14,17H,3-4,12-13,15-16H2,1-2H3,(H,24,28)