N-(5-methylhexan-2-yl)-4-(3-oxidanylidenepiperazin-1-yl)sulfonyl-benzamide

Systemtic Name: N-(5-methylhexan-2-yl)-4-(3-oxidanylidenepiperazin-1-yl)sulfonyl-benzamide Openeye Name: N-(1,4-dimethylpentyl)-4-(3-oxopiperazin-1-yl)sulfonyl-benzamide CAS Name: N-(5-methylhexan-2-yl)-4-[(3-oxo-1-piperazinyl)sulfonyl]benzamide IUPAC Name: N-(5-methylhexan-2-yl)-4-(3-oxopiperazin-1-yl)sulfonylbenzamide Traditional Name: N-(1,4-dimethylpentyl)-4-(3-ketopiperazino)sulfonyl-benzamide Formula: C18H27N3O4S MolecularWeight: 381.48968

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(C)NC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCNC(=O)C2

Isomeric SMILES

CC(C)CCC(C)NC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCNC(=O)C2

InChI

InChI=1S/C18H27N3O4S/c1-13(2)4-5-14(3)20-18(23)15-6-8-16(9-7-15)26(24,25)21-11-10-19-17(22)12-21/h6-9,13-14H,4-5,10-12H2,1-3H3,(H,19,22)(H,20,23)