3-(2-methylpiperidin-1-yl)sulfonyl-N-[[4-(2-methylpropanoylamino)phenyl]methyl]benzamide

Systemtic Name: 3-(2-methylpiperidin-1-yl)sulfonyl-N-[[4-(2-methylpropanoylamino)phenyl]methyl]benzamide Openeye Name: 3-[(2-methyl-1-piperidyl)sulfonyl]-N-[[4-(2-methylpropanoylamino)phenyl]methyl]benzamide CAS Name: N-[[4-[(2-methyl-1-oxopropyl)amino]phenyl]methyl]-3-[(2-methyl-1-piperidinyl)sulfonyl]benzamide IUPAC Name: 3-(2-methylpiperidin-1-yl)sulfonyl-N-[[4-(2-methylpropanoylamino)phenyl]methyl]benzamide Traditional Name: N-[4-(isobutyrylamino)benzyl]-3-(2-methylpiperidino)sulfonyl-benzamide Formula: C24H31N3O4S MolecularWeight: 457.58564

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1S(=O)(=O)C2=CC=CC(=C2)C(=O)NCC3=CC=C(C=C3)NC(=O)C(C)C

Isomeric SMILES

CC1CCCCN1S(=O)(=O)C2=CC=CC(=C2)C(=O)NCC3=CC=C(C=C3)NC(=O)C(C)C

InChI

InChI=1S/C24H31N3O4S/c1-17(2)23(28)26-21-12-10-19(11-13-21)16-25-24(29)20-8-6-9-22(15-20)32(30,31)27-14-5-4-7-18(27)3/h6,8-13,15,17-18H,4-5,7,14,16H2,1-3H3,(H,25,29)(H,26,28)