methyl 4-cyano-3-[1-(3,4-dichlorophenyl)propyl]-2-sulfanylidene-1H-imidazole-5-carboxylate

Systemtic Name: methyl 4-cyano-3-[1-(3,4-dichlorophenyl)propyl]-2-sulfanylidene-1H-imidazole-5-carboxylate Openeye Name: methyl 4-cyano-3-[1-(3,4-dichlorophenyl)propyl]-2-thioxo-1H-imidazole-5-carboxylate CAS Name: 4-cyano-3-[1-(3,4-dichlorophenyl)propyl]-2-sulfanylidene-1H-imidazole-5-carboxylic acid methyl ester IUPAC Name: methyl 4-cyano-3-[1-(3,4-dichlorophenyl)propyl]-2-sulfanylidene-1H-imidazole-5-carboxylate Traditional Name: 5-cyano-1-[1-(3,4-dichlorophenyl)propyl]-2-thioxo-4-imidazoline-4-carboxylic acid methyl ester Formula: C15H13Cl2N3O2S MolecularWeight: 370.25362

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC(=C(C=C1)Cl)Cl)N2C(=C(NC2=S)C(=O)OC)C#N

Isomeric SMILES

CCC(C1=CC(=C(C=C1)Cl)Cl)N2C(=C(NC2=S)C(=O)OC)C#N

InChI

InChI=1S/C15H13Cl2N3O2S/c1-3-11(8-4-5-9(16)10(17)6-8)20-12(7-18)13(14(21)22-2)19-15(20)23/h4-6,11H,3H2,1-2H3,(H,19,23)