2-(4-methylpiperazin-1-yl)carbonyl-N-(2-sulfanylidene-3H-1,3-benzothiazol-6-yl)benzamide

Systemtic Name: 2-(4-methylpiperazin-1-yl)carbonyl-N-(2-sulfanylidene-3H-1,3-benzothiazol-6-yl)benzamide Openeye Name: 2-(4-methylpiperazine-1-carbonyl)-N-(2-thioxo-3H-1,3-benzothiazol-6-yl)benzamide CAS Name: 2-[(4-methyl-1-piperazinyl)-oxomethyl]-N-(2-sulfanylidene-3H-1,3-benzothiazol-6-yl)benzamide IUPAC Name: 2-(4-methylpiperazine-1-carbonyl)-N-(2-sulfanylidene-3H-1,3-benzothiazol-6-yl)benzamide Traditional Name: 2-(4-methylpiperazine-1-carbonyl)-N-(2-thioxo-3H-1,3-benzothiazol-6-yl)benzamide Formula: C20H20N4O2S2 MolecularWeight: 412.5284

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)C2=CC=CC=C2C(=O)NC3=CC4=C(C=C3)NC(=S)S4

Isomeric SMILES

CN1CCN(CC1)C(=O)C2=CC=CC=C2C(=O)NC3=CC4=C(C=C3)NC(=S)S4

InChI

InChI=1S/C20H20N4O2S2/c1-23-8-10-24(11-9-23)19(26)15-5-3-2-4-14(15)18(25)21-13-6-7-16-17(12-13)28-20(27)22-16/h2-7,12H,8-11H2,1H3,(H,21,25)(H,22,27)