N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-5-(2,3-dihydroindol-1-ylsulfonyl)-2-methoxy-benzamide

Systemtic Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-5-(2,3-dihydroindol-1-ylsulfonyl)-2-methoxy-benzamide Openeye Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-5-indolin-1-ylsulfonyl-2-methoxy-benzamide CAS Name: N-[3-(1-azepanylsulfonyl)-4-methylphenyl]-5-(2,3-dihydroindol-1-ylsulfonyl)-2-methoxybenzamide IUPAC Name: N-[3-(azepan-1-ylsulfonyl)-4-methylphenyl]-5-(2,3-dihydroindol-1-ylsulfonyl)-2-methoxybenzamide Traditional Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-5-indolin-1-ylsulfonyl-2-methoxy-benzamide Formula: C29H33N3O6S2 MolecularWeight: 583.71882

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCC4=CC=CC=C43)OC)S(=O)(=O)N5CCCCCC5

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCC4=CC=CC=C43)OC)S(=O)(=O)N5CCCCCC5

InChI

InChI=1S/C29H33N3O6S2/c1-21-11-12-23(19-28(21)40(36,37)31-16-7-3-4-8-17-31)30-29(33)25-20-24(13-14-27(25)38-2)39(34,35)32-18-15-22-9-5-6-10-26(22)32/h5-6,9-14,19-20H,3-4,7-8,15-18H2,1-2H3,(H,30,33)