3-chloranyl-4-methyl-N-[(6-oxidanyl-1,3-benzothiazol-2-yl)carbamothioyl]benzamide

Systemtic Name: 3-chloranyl-4-methyl-N-[(6-oxidanyl-1,3-benzothiazol-2-yl)carbamothioyl]benzamide Openeye Name: 3-chloro-N-[(6-hydroxy-1,3-benzothiazol-2-yl)carbamothioyl]-4-methyl-benzamide CAS Name: 3-chloro-N-[[(6-hydroxy-1,3-benzothiazol-2-yl)amino]-sulfanylidenemethyl]-4-methylbenzamide IUPAC Name: 3-chloro-N-[(6-hydroxy-1,3-benzothiazol-2-yl)carbamothioyl]-4-methylbenzamide Traditional Name: 3-chloro-N-[(6-hydroxy-1,3-benzothiazol-2-yl)thiocarbamoyl]-4-methyl-benzamide Formula: C16H12ClN3O2S2 MolecularWeight: 377.86838

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC(=S)NC2=NC3=C(S2)C=C(C=C3)O)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC(=S)NC2=NC3=C(S2)C=C(C=C3)O)Cl

InChI

InChI=1S/C16H12ClN3O2S2/c1-8-2-3-9(6-11(8)17)14(22)19-15(23)20-16-18-12-5-4-10(21)7-13(12)24-16/h2-7,21H,1H3,(H2,18,19,20,22,23)