(2-chloranyl-7-methylsulfanyl-quinolin-3-yl)methyl 1,3-benzothiazole-6-carboxylate

Systemtic Name: (2-chloranyl-7-methylsulfanyl-quinolin-3-yl)methyl 1,3-benzothiazole-6-carboxylate Openeye Name: (2-chloro-7-methylsulfanyl-3-quinolyl)methyl 1,3-benzothiazole-6-carboxylate CAS Name: 1,3-benzothiazole-6-carboxylic acid [2-chloro-7-(methylthio)-3-quinolinyl]methyl ester IUPAC Name: (2-chloro-7-methylsulfanylquinolin-3-yl)methyl 1,3-benzothiazole-6-carboxylate Traditional Name: 1,3-benzothiazole-6-carboxylic acid [2-chloro-7-(methylthio)-3-quinolyl]methyl ester Formula: C19H13ClN2O2S2 MolecularWeight: 400.90172

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC2=NC(=C(C=C2C=C1)COC(=O)C3=CC4=C(C=C3)N=CS4)Cl

Isomeric SMILES

CSC1=CC2=NC(=C(C=C2C=C1)COC(=O)C3=CC4=C(C=C3)N=CS4)Cl

InChI

InChI=1S/C19H13ClN2O2S2/c1-25-14-4-2-11-6-13(18(20)22-16(11)8-14)9-24-19(23)12-3-5-15-17(7-12)26-10-21-15/h2-8,10H,9H2,1H3