5-chloranyl-N-[(4,7-dimethyl-1,3-benzothiazol-2-yl)carbamothioyl]-2-methoxy-benzamide

Systemtic Name: 5-chloranyl-N-[(4,7-dimethyl-1,3-benzothiazol-2-yl)carbamothioyl]-2-methoxy-benzamide Openeye Name: 5-chloro-N-[(4,7-dimethyl-1,3-benzothiazol-2-yl)carbamothioyl]-2-methoxy-benzamide CAS Name: 5-chloro-N-[[(4,7-dimethyl-1,3-benzothiazol-2-yl)amino]-sulfanylidenemethyl]-2-methoxybenzamide IUPAC Name: 5-chloro-N-[(4,7-dimethyl-1,3-benzothiazol-2-yl)carbamothioyl]-2-methoxybenzamide Traditional Name: 5-chloro-N-[(4,7-dimethyl-1,3-benzothiazol-2-yl)thiocarbamoyl]-2-methoxy-benzamide Formula: C18H16ClN3O2S2 MolecularWeight: 405.92154

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C=C1)C)SC(=N2)NC(=S)NC(=O)C3=C(C=CC(=C3)Cl)OC

Isomeric SMILES

CC1=C2C(=C(C=C1)C)SC(=N2)NC(=S)NC(=O)C3=C(C=CC(=C3)Cl)OC

InChI

InChI=1S/C18H16ClN3O2S2/c1-9-4-5-10(2)15-14(9)20-18(26-15)22-17(25)21-16(23)12-8-11(19)6-7-13(12)24-3/h4-8H,1-3H3,(H2,20,21,22,23,25)