3-(4-ethanoylpiperazin-1-yl)sulfonyl-N-(6-methyl-1,3-benzothiazol-2-yl)benzamide

Systemtic Name: 3-(4-ethanoylpiperazin-1-yl)sulfonyl-N-(6-methyl-1,3-benzothiazol-2-yl)benzamide Openeye Name: 3-(4-acetylpiperazin-1-yl)sulfonyl-N-(6-methyl-1,3-benzothiazol-2-yl)benzamide CAS Name: 3-[(4-acetyl-1-piperazinyl)sulfonyl]-N-(6-methyl-1,3-benzothiazol-2-yl)benzamide IUPAC Name: 3-(4-acetylpiperazin-1-yl)sulfonyl-N-(6-methyl-1,3-benzothiazol-2-yl)benzamide Traditional Name: 3-(4-acetylpiperazino)sulfonyl-N-(6-methyl-1,3-benzothiazol-2-yl)benzamide Formula: C21H22N4O4S2 MolecularWeight: 458.55378

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCN(CC4)C(=O)C

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCN(CC4)C(=O)C

InChI

InChI=1S/C21H22N4O4S2/c1-14-6-7-18-19(12-14)30-21(22-18)23-20(27)16-4-3-5-17(13-16)31(28,29)25-10-8-24(9-11-25)15(2)26/h3-7,12-13H,8-11H2,1-2H3,(H,22,23,27)