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

Systemtic Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-3-[(2-methyl-2,3-dihydroindol-1-yl)sulfonyl]benzamide Openeye Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-3-(2-methylindolin-1-yl)sulfonyl-benzamide CAS Name: N-[3-(1-azepanylsulfonyl)-4-methylphenyl]-3-[(2-methyl-2,3-dihydroindol-1-yl)sulfonyl]benzamide IUPAC Name: N-[3-(azepan-1-ylsulfonyl)-4-methylphenyl]-3-[(2-methyl-2,3-dihydroindol-1-yl)sulfonyl]benzamide Traditional Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-3-(2-methylindolin-1-yl)sulfonyl-benzamide Formula: C29H33N3O5S2 MolecularWeight: 567.71942

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=CC=CC=C2N1S(=O)(=O)C3=CC=CC(=C3)C(=O)NC4=CC(=C(C=C4)C)S(=O)(=O)N5CCCCCC5

Isomeric SMILES

CC1CC2=CC=CC=C2N1S(=O)(=O)C3=CC=CC(=C3)C(=O)NC4=CC(=C(C=C4)C)S(=O)(=O)N5CCCCCC5

InChI

InChI=1S/C29H33N3O5S2/c1-21-14-15-25(20-28(21)39(36,37)31-16-7-3-4-8-17-31)30-29(33)24-11-9-12-26(19-24)38(34,35)32-22(2)18-23-10-5-6-13-27(23)32/h5-6,9-15,19-20,22H,3-4,7-8,16-18H2,1-2H3,(H,30,33)