4-chloranyl-N-[4-(3-methylbutanoylamino)phenyl]-3-(3-methylpiperidin-1-yl)sulfonyl-benzamide

Systemtic Name: 4-chloranyl-N-[4-(3-methylbutanoylamino)phenyl]-3-(3-methylpiperidin-1-yl)sulfonyl-benzamide Openeye Name: 4-chloro-N-[4-(3-methylbutanoylamino)phenyl]-3-[(3-methyl-1-piperidyl)sulfonyl]benzamide CAS Name: 4-chloro-N-[4-[(3-methyl-1-oxobutyl)amino]phenyl]-3-[(3-methyl-1-piperidinyl)sulfonyl]benzamide IUPAC Name: 4-chloro-N-[4-(3-methylbutanoylamino)phenyl]-3-(3-methylpiperidin-1-yl)sulfonylbenzamide Traditional Name: 4-chloro-N-[4-(isovalerylamino)phenyl]-3-(3-methylpiperidino)sulfonyl-benzamide Formula: C24H30ClN3O4S MolecularWeight: 492.0307

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NC3=CC=C(C=C3)NC(=O)CC(C)C)Cl

Isomeric SMILES

CC1CCCN(C1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NC3=CC=C(C=C3)NC(=O)CC(C)C)Cl

InChI

InChI=1S/C24H30ClN3O4S/c1-16(2)13-23(29)26-19-7-9-20(10-8-19)27-24(30)18-6-11-21(25)22(14-18)33(31,32)28-12-4-5-17(3)15-28/h6-11,14,16-17H,4-5,12-13,15H2,1-3H3,(H,26,29)(H,27,30)