methyl 3-[1-(3-chlorophenyl)propyl]-2-sulfanylidene-1H-imidazole-4-carboxylate

Systemtic Name: methyl 3-[1-(3-chlorophenyl)propyl]-2-sulfanylidene-1H-imidazole-4-carboxylate Openeye Name: methyl 3-[1-(3-chlorophenyl)propyl]-2-thioxo-1H-imidazole-4-carboxylate CAS Name: 3-[1-(3-chlorophenyl)propyl]-2-sulfanylidene-1H-imidazole-4-carboxylic acid methyl ester IUPAC Name: methyl 3-[1-(3-chlorophenyl)propyl]-2-sulfanylidene-1H-imidazole-4-carboxylate Traditional Name: 3-[1-(3-chlorophenyl)propyl]-2-thioxo-4-imidazoline-4-carboxylic acid methyl ester Formula: C14H15ClN2O2S MolecularWeight: 310.7991

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC(=CC=C1)Cl)N2C(=CNC2=S)C(=O)OC

Isomeric SMILES

CCC(C1=CC(=CC=C1)Cl)N2C(=CNC2=S)C(=O)OC

InChI

InChI=1S/C14H15ClN2O2S/c1-3-11(9-5-4-6-10(15)7-9)17-12(13(18)19-2)8-16-14(17)20/h4-8,11H,3H2,1-2H3,(H,16,20)