N-(3,4-dimethylphenyl)-3-(4-ethanoylpiperazin-1-yl)sulfonyl-benzamide

Systemtic Name: N-(3,4-dimethylphenyl)-3-(4-ethanoylpiperazin-1-yl)sulfonyl-benzamide Openeye Name: 3-(4-acetylpiperazin-1-yl)sulfonyl-N-(3,4-dimethylphenyl)benzamide CAS Name: 3-[(4-acetyl-1-piperazinyl)sulfonyl]-N-(3,4-dimethylphenyl)benzamide IUPAC Name: 3-(4-acetylpiperazin-1-yl)sulfonyl-N-(3,4-dimethylphenyl)benzamide Traditional Name: 3-(4-acetylpiperazino)sulfonyl-N-(3,4-dimethylphenyl)benzamide Formula: C21H25N3O4S MolecularWeight: 415.5059

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCN(CC3)C(=O)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCN(CC3)C(=O)C)C

InChI

InChI=1S/C21H25N3O4S/c1-15-7-8-19(13-16(15)2)22-21(26)18-5-4-6-20(14-18)29(27,28)24-11-9-23(10-12-24)17(3)25/h4-8,13-14H,9-12H2,1-3H3,(H,22,26)