N-[[3-(methoxymethyl)phenyl]methyl]-3-[4-(phenylmethyl)piperazin-1-yl]sulfonyl-benzamide

Systemtic Name: N-[[3-(methoxymethyl)phenyl]methyl]-3-[4-(phenylmethyl)piperazin-1-yl]sulfonyl-benzamide Openeye Name: 3-(4-benzylpiperazin-1-yl)sulfonyl-N-[[3-(methoxymethyl)phenyl]methyl]benzamide CAS Name: N-[[3-(methoxymethyl)phenyl]methyl]-3-[[4-(phenylmethyl)-1-piperazinyl]sulfonyl]benzamide IUPAC Name: 3-(4-benzylpiperazin-1-yl)sulfonyl-N-[[3-(methoxymethyl)phenyl]methyl]benzamide Traditional Name: 3-(4-benzylpiperazino)sulfonyl-N-[3-(methoxymethyl)benzyl]benzamide Formula: C27H31N3O4S MolecularWeight: 493.61774

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Descriptors Computed from Structure

Canonical SMILES:

COCC1=CC=CC(=C1)CNC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

COCC1=CC=CC(=C1)CNC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C27H31N3O4S/c1-34-21-24-10-5-9-23(17-24)19-28-27(31)25-11-6-12-26(18-25)35(32,33)30-15-13-29(14-16-30)20-22-7-3-2-4-8-22/h2-12,17-18H,13-16,19-21H2,1H3,(H,28,31)