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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

CCCCCNC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCN(CC2)CC3=CC=CC=C3

InChI

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