N-(3-methyl-1-phenyl-butyl)-4-(3-oxidanylidenepiperazin-1-yl)sulfonyl-benzamide

Systemtic Name: N-(3-methyl-1-phenyl-butyl)-4-(3-oxidanylidenepiperazin-1-yl)sulfonyl-benzamide Openeye Name: N-(3-methyl-1-phenyl-butyl)-4-(3-oxopiperazin-1-yl)sulfonyl-benzamide CAS Name: N-(3-methyl-1-phenylbutyl)-4-[(3-oxo-1-piperazinyl)sulfonyl]benzamide IUPAC Name: N-(3-methyl-1-phenylbutyl)-4-(3-oxopiperazin-1-yl)sulfonylbenzamide Traditional Name: 4-(3-ketopiperazino)sulfonyl-N-(3-methyl-1-phenyl-butyl)benzamide Formula: C22H27N3O4S MolecularWeight: 429.53248

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27N3O4S/c1-16(2)14-20(17-6-4-3-5-7-17)24-22(27)18-8-10-19(11-9-18)30(28,29)25-13-12-23-21(26)15-25/h3-11,16,20H,12-15H2,1-2H3,(H,23,26)(H,24,27)