N-(1,3-benzodioxol-5-yl)-3-(4-ethanoylpiperazin-1-yl)sulfonyl-benzamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-3-(4-ethanoylpiperazin-1-yl)sulfonyl-benzamide Openeye Name: 3-(4-acetylpiperazin-1-yl)sulfonyl-N-(1,3-benzodioxol-5-yl)benzamide CAS Name: 3-[(4-acetyl-1-piperazinyl)sulfonyl]-N-(1,3-benzodioxol-5-yl)benzamide IUPAC Name: 3-(4-acetylpiperazin-1-yl)sulfonyl-N-(1,3-benzodioxol-5-yl)benzamide Traditional Name: 3-(4-acetylpiperazino)sulfonyl-N-(1,3-benzodioxol-5-yl)benzamide Formula: C20H21N3O6S MolecularWeight: 431.46224

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H21N3O6S/c1-14(24)22-7-9-23(10-8-22)30(26,27)17-4-2-3-15(11-17)20(25)21-16-5-6-18-19(12-16)29-13-28-18/h2-6,11-12H,7-10,13H2,1H3,(H,21,25)