methyl 2-(3-ethylsulfanylphenyl)carbonylimino-3-methyl-1,3-benzothiazole-6-carboxylate

Systemtic Name: methyl 2-(3-ethylsulfanylphenyl)carbonylimino-3-methyl-1,3-benzothiazole-6-carboxylate Openeye Name: methyl 2-(3-ethylsulfanylbenzoyl)imino-3-methyl-1,3-benzothiazole-6-carboxylate CAS Name: 2-[[3-(ethylthio)phenyl]-oxomethyl]imino-3-methyl-1,3-benzothiazole-6-carboxylic acid methyl ester IUPAC Name: methyl 2-(3-ethylsulfanylbenzoyl)imino-3-methyl-1,3-benzothiazole-6-carboxylate Traditional Name: 2-[3-(ethylthio)benzoyl]imino-3-methyl-1,3-benzothiazole-6-carboxylic acid methyl ester Formula: C19H18N2O3S2 MolecularWeight: 386.48782

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=CC=CC(=C1)C(=O)N=C2N(C3=C(S2)C=C(C=C3)C(=O)OC)C

Isomeric SMILES

CCSC1=CC=CC(=C1)C(=O)N=C2N(C3=C(S2)C=C(C=C3)C(=O)OC)C

InChI

InChI=1S/C19H18N2O3S2/c1-4-25-14-7-5-6-12(10-14)17(22)20-19-21(2)15-9-8-13(18(23)24-3)11-16(15)26-19/h5-11H,4H2,1-3H3