N-pentan-2-yl-3-[4-(phenylmethyl)piperazin-1-yl]sulfonyl-benzamide

Systemtic Name: N-pentan-2-yl-3-[4-(phenylmethyl)piperazin-1-yl]sulfonyl-benzamide Openeye Name: 3-(4-benzylpiperazin-1-yl)sulfonyl-N-(1-methylbutyl)benzamide CAS Name: N-pentan-2-yl-3-[[4-(phenylmethyl)-1-piperazinyl]sulfonyl]benzamide IUPAC Name: 3-(4-benzylpiperazin-1-yl)sulfonyl-N-pentan-2-ylbenzamide Traditional Name: 3-(4-benzylpiperazino)sulfonyl-N-(1-methylbutyl)benzamide Formula: C23H31N3O3S MolecularWeight: 429.57554

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)NC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

CCCC(C)NC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C23H31N3O3S/c1-3-8-19(2)24-23(27)21-11-7-12-22(17-21)30(28,29)26-15-13-25(14-16-26)18-20-9-5-4-6-10-20/h4-7,9-12,17,19H,3,8,13-16,18H2,1-2H3,(H,24,27)