N-[(3,4-dimethoxyphenyl)methyl]-3-(4-ethanoylpiperazin-1-yl)sulfonyl-benzamide

Systemtic Name: N-[(3,4-dimethoxyphenyl)methyl]-3-(4-ethanoylpiperazin-1-yl)sulfonyl-benzamide Openeye Name: 3-(4-acetylpiperazin-1-yl)sulfonyl-N-[(3,4-dimethoxyphenyl)methyl]benzamide CAS Name: 3-[(4-acetyl-1-piperazinyl)sulfonyl]-N-[(3,4-dimethoxyphenyl)methyl]benzamide IUPAC Name: 3-(4-acetylpiperazin-1-yl)sulfonyl-N-[(3,4-dimethoxyphenyl)methyl]benzamide Traditional Name: 3-(4-acetylpiperazino)sulfonyl-N-veratryl-benzamide Formula: C22H27N3O6S MolecularWeight: 461.53128

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NCC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NCC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C22H27N3O6S/c1-16(26)24-9-11-25(12-10-24)32(28,29)19-6-4-5-18(14-19)22(27)23-15-17-7-8-20(30-2)21(13-17)31-3/h4-8,13-14H,9-12,15H2,1-3H3,(H,23,27)