N-(4-bromophenyl)-4-(1-methylindol-5-yl)sulfonyl-1,4-diazepane-1-carboxamide

Systemtic Name: N-(4-bromophenyl)-4-(1-methylindol-5-yl)sulfonyl-1,4-diazepane-1-carboxamide Openeye Name: N-(4-bromophenyl)-4-(1-methylindol-5-yl)sulfonyl-1,4-diazepane-1-carboxamide CAS Name: N-(4-bromophenyl)-4-[(1-methyl-5-indolyl)sulfonyl]-1,4-diazepane-1-carboxamide IUPAC Name: N-(4-bromophenyl)-4-(1-methylindol-5-yl)sulfonyl-1,4-diazepane-1-carboxamide Traditional Name: N-(4-bromophenyl)-4-(1-methylindol-5-yl)sulfonyl-1,4-diazepane-1-carboxamide Formula: C21H23BrN4O3S MolecularWeight: 491.40132

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC2=C1C=CC(=C2)S(=O)(=O)N3CCCN(CC3)C(=O)NC4=CC=C(C=C4)Br

Isomeric SMILES

CN1C=CC2=C1C=CC(=C2)S(=O)(=O)N3CCCN(CC3)C(=O)NC4=CC=C(C=C4)Br

InChI

InChI=1S/C21H23BrN4O3S/c1-24-12-9-16-15-19(7-8-20(16)24)30(28,29)26-11-2-10-25(13-14-26)21(27)23-18-5-3-17(22)4-6-18/h3-9,12,15H,2,10-11,13-14H2,1H3,(H,23,27)