N-[(3-methylbenzo[g][1,3]benzothiazol-2-ylidene)carbamothioyl]-4-(phenylcarbonyl)benzamide

Systemtic Name: N-[(3-methylbenzo[g][1,3]benzothiazol-2-ylidene)carbamothioyl]-4-(phenylcarbonyl)benzamide Openeye Name: 4-benzoyl-N-[(3-methylbenzo[g][1,3]benzothiazol-2-ylidene)carbamothioyl]benzamide CAS Name: 4-benzoyl-N-[[(3-methyl-2-benzo[g][1,3]benzothiazolylidene)amino]-sulfanylidenemethyl]benzamide IUPAC Name: 4-benzoyl-N-[(3-methylbenzo[g][1,3]benzothiazol-2-ylidene)carbamothioyl]benzamide Traditional Name: 4-benzoyl-N-[(3-methylbenzo[g][1,3]benzothiazol-2-ylidene)thiocarbamoyl]benzamide Formula: C27H19N3O2S2 MolecularWeight: 481.58866

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C3=CC=CC=C3C=C2)SC1=NC(=S)NC(=O)C4=CC=C(C=C4)C(=O)C5=CC=CC=C5

Isomeric SMILES

CN1C2=C(C3=CC=CC=C3C=C2)SC1=NC(=S)NC(=O)C4=CC=C(C=C4)C(=O)C5=CC=CC=C5

InChI

InChI=1S/C27H19N3O2S2/c1-30-22-16-15-17-7-5-6-10-21(17)24(22)34-27(30)29-26(33)28-25(32)20-13-11-19(12-14-20)23(31)18-8-3-2-4-9-18/h2-16H,1H3,(H,28,32,33)