N-[(5-chloranyl-6-methoxy-1,3-benzothiazol-2-yl)carbamothioyl]-2,2-diphenyl-ethanamide

Systemtic Name: N-[(5-chloranyl-6-methoxy-1,3-benzothiazol-2-yl)carbamothioyl]-2,2-diphenyl-ethanamide Openeye Name: N-[(5-chloro-6-methoxy-1,3-benzothiazol-2-yl)carbamothioyl]-2,2-diphenyl-acetamide CAS Name: N-[[(5-chloro-6-methoxy-1,3-benzothiazol-2-yl)amino]-sulfanylidenemethyl]-2,2-diphenylacetamide IUPAC Name: N-[(5-chloro-6-methoxy-1,3-benzothiazol-2-yl)carbamothioyl]-2,2-diphenylacetamide Traditional Name: N-[(5-chloro-6-methoxy-1,3-benzothiazol-2-yl)thiocarbamoyl]-2,2-diphenyl-acetamide Formula: C23H18ClN3O2S2 MolecularWeight: 467.99092

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)SC(=N2)NC(=S)NC(=O)C(C3=CC=CC=C3)C4=CC=CC=C4)Cl

Isomeric SMILES

COC1=C(C=C2C(=C1)SC(=N2)NC(=S)NC(=O)C(C3=CC=CC=C3)C4=CC=CC=C4)Cl

InChI

InChI=1S/C23H18ClN3O2S2/c1-29-18-13-19-17(12-16(18)24)25-23(31-19)27-22(30)26-21(28)20(14-8-4-2-5-9-14)15-10-6-3-7-11-15/h2-13,20H,1H3,(H2,25,26,27,28,30)