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

Systemtic Name: 3-[4-(phenylmethyl)piperazin-1-yl]sulfonyl-N-(2-propoxyphenyl)benzamide Openeye Name: 3-(4-benzylpiperazin-1-yl)sulfonyl-N-(2-propoxyphenyl)benzamide CAS Name: 3-[[4-(phenylmethyl)-1-piperazinyl]sulfonyl]-N-(2-propoxyphenyl)benzamide IUPAC Name: 3-(4-benzylpiperazin-1-yl)sulfonyl-N-(2-propoxyphenyl)benzamide Traditional Name: 3-(4-benzylpiperazino)sulfonyl-N-(2-propoxyphenyl)benzamide Formula: C27H31N3O4S MolecularWeight: 493.61774

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC=C1NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

CCCOC1=CC=CC=C1NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C27H31N3O4S/c1-2-19-34-26-14-7-6-13-25(26)28-27(31)23-11-8-12-24(20-23)35(32,33)30-17-15-29(16-18-30)21-22-9-4-3-5-10-22/h3-14,20H,2,15-19,21H2,1H3,(H,28,31)