methyl 3-(1-phenylethyl)-2-sulfanylidene-1H-imidazole-4-carboxylate

Systemtic Name: methyl 3-(1-phenylethyl)-2-sulfanylidene-1H-imidazole-4-carboxylate Openeye Name: methyl 3-(1-phenylethyl)-2-thioxo-1H-imidazole-4-carboxylate CAS Name: 3-(1-phenylethyl)-2-sulfanylidene-1H-imidazole-4-carboxylic acid methyl ester IUPAC Name: methyl 3-(1-phenylethyl)-2-sulfanylidene-1H-imidazole-4-carboxylate Traditional Name: 3-(1-phenylethyl)-2-thioxo-4-imidazoline-4-carboxylic acid methyl ester Formula: C13H14N2O2S MolecularWeight: 262.32746

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H14N2O2S/c1-9(10-6-4-3-5-7-10)15-11(12(16)17-2)8-14-13(15)18/h3-9H,1-2H3,(H,14,18)