N-[1-[4-(2-methylpropyl)phenyl]ethyl]-4-(3-oxidanylidenepiperazin-1-yl)sulfonyl-benzamide

Systemtic Name: N-[1-[4-(2-methylpropyl)phenyl]ethyl]-4-(3-oxidanylidenepiperazin-1-yl)sulfonyl-benzamide Openeye Name: N-[1-(4-isobutylphenyl)ethyl]-4-(3-oxopiperazin-1-yl)sulfonyl-benzamide CAS Name: N-[1-[4-(2-methylpropyl)phenyl]ethyl]-4-[(3-oxo-1-piperazinyl)sulfonyl]benzamide IUPAC Name: N-[1-[4-(2-methylpropyl)phenyl]ethyl]-4-(3-oxopiperazin-1-yl)sulfonylbenzamide Traditional Name: N-[1-(4-isobutylphenyl)ethyl]-4-(3-ketopiperazino)sulfonyl-benzamide Formula: C23H29N3O4S MolecularWeight: 443.55906

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC=C(C=C1)C(C)NC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCNC(=O)C3

Isomeric SMILES

CC(C)CC1=CC=C(C=C1)C(C)NC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCNC(=O)C3

InChI

InChI=1S/C23H29N3O4S/c1-16(2)14-18-4-6-19(7-5-18)17(3)25-23(28)20-8-10-21(11-9-20)31(29,30)26-13-12-24-22(27)15-26/h4-11,16-17H,12-15H2,1-3H3,(H,24,27)(H,25,28)