N-[3-[4-(3-methylphenyl)piperazin-1-yl]propyl]-3-(3-oxidanylidenepiperazin-1-yl)sulfonyl-benzamide

Systemtic Name: N-[3-[4-(3-methylphenyl)piperazin-1-yl]propyl]-3-(3-oxidanylidenepiperazin-1-yl)sulfonyl-benzamide Openeye Name: N-[3-[4-(m-tolyl)piperazin-1-yl]propyl]-3-(3-oxopiperazin-1-yl)sulfonyl-benzamide CAS Name: N-[3-[4-(3-methylphenyl)-1-piperazinyl]propyl]-3-[(3-oxo-1-piperazinyl)sulfonyl]benzamide IUPAC Name: N-[3-[4-(3-methylphenyl)piperazin-1-yl]propyl]-3-(3-oxopiperazin-1-yl)sulfonylbenzamide Traditional Name: 3-(3-ketopiperazino)sulfonyl-N-[3-[4-(m-tolyl)piperazino]propyl]benzamide Formula: C25H33N5O4S MolecularWeight: 499.62562

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CCN(CC2)CCCNC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCNC(=O)C4

Isomeric SMILES

CC1=CC(=CC=C1)N2CCN(CC2)CCCNC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCNC(=O)C4

InChI

InChI=1S/C25H33N5O4S/c1-20-5-2-7-22(17-20)29-15-13-28(14-16-29)11-4-9-27-25(32)21-6-3-8-23(18-21)35(33,34)30-12-10-26-24(31)19-30/h2-3,5-8,17-18H,4,9-16,19H2,1H3,(H,26,31)(H,27,32)