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

Systemtic Name: N-[(E)-(3-methyl-1,3-benzothiazol-2-ylidene)carbamothioyl]-4-(phenylcarbonyl)benzamide Openeye Name: 4-benzoyl-N-[(E)-(3-methyl-1,3-benzothiazol-2-ylidene)carbamothioyl]benzamide CAS Name: 4-benzoyl-N-[[(E)-(3-methyl-1,3-benzothiazol-2-ylidene)amino]-sulfanylidenemethyl]benzamide IUPAC Name: 4-benzoyl-N-[(E)-(3-methyl-1,3-benzothiazol-2-ylidene)carbamothioyl]benzamide Traditional Name: 4-benzoyl-N-[(E)-(3-methyl-1,3-benzothiazol-2-ylidene)thiocarbamoyl]benzamide Formula: C23H17N3O2S2 MolecularWeight: 431.52998

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2SC1=NC(=S)NC(=O)C3=CC=C(C=C3)C(=O)C4=CC=CC=C4

Isomeric SMILES

CN\1C2=CC=CC=C2S/C1=N/C(=S)NC(=O)C3=CC=C(C=C3)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C23H17N3O2S2/c1-26-18-9-5-6-10-19(18)30-23(26)25-22(29)24-21(28)17-13-11-16(12-14-17)20(27)15-7-3-2-4-8-15/h2-14H,1H3,(H,24,28,29)/b25-23+