methyl 3-(2-methylsulfanylethyl)-2-naphthalen-1-ylcarbonylimino-1,3-benzothiazole-6-carboxylate

Systemtic Name: methyl 3-(2-methylsulfanylethyl)-2-naphthalen-1-ylcarbonylimino-1,3-benzothiazole-6-carboxylate Openeye Name: methyl 3-(2-methylsulfanylethyl)-2-(naphthalene-1-carbonylimino)-1,3-benzothiazole-6-carboxylate CAS Name: 3-[2-(methylthio)ethyl]-2-[1-naphthalenyl(oxo)methyl]imino-1,3-benzothiazole-6-carboxylic acid methyl ester IUPAC Name: methyl 3-(2-methylsulfanylethyl)-2-(naphthalene-1-carbonylimino)-1,3-benzothiazole-6-carboxylate Traditional Name: 3-[2-(methylthio)ethyl]-2-(1-naphthoylimino)-1,3-benzothiazole-6-carboxylic acid methyl ester Formula: C23H20N2O3S2 MolecularWeight: 436.5465

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)N(C(=NC(=O)C3=CC=CC4=CC=CC=C43)S2)CCSC

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)N(C(=NC(=O)C3=CC=CC4=CC=CC=C43)S2)CCSC

InChI

InChI=1S/C23H20N2O3S2/c1-28-22(27)16-10-11-19-20(14-16)30-23(25(19)12-13-29-2)24-21(26)18-9-5-7-15-6-3-4-8-17(15)18/h3-11,14H,12-13H2,1-2H3