ethyl 4-[[C-methylsulfanyl-N-(phenylcarbonyl)carbonimidoyl]amino]-1H-imidazole-5-carboxylate

Systemtic Name: ethyl 4-[[C-methylsulfanyl-N-(phenylcarbonyl)carbonimidoyl]amino]-1H-imidazole-5-carboxylate Openeye Name: ethyl 4-[(N-benzoyl-C-methylsulfanyl-carbonimidoyl)amino]-1H-imidazole-5-carboxylate CAS Name: 4-[[benzoylimino-(methylthio)methyl]amino]-1H-imidazole-5-carboxylic acid ethyl ester IUPAC Name: ethyl 4-[(N-benzoyl-C-methylsulfanylcarbonimidoyl)amino]-1H-imidazole-5-carboxylate Traditional Name: 4-[[N-benzoyl-C-(methylthio)carbonimidoyl]amino]-1H-imidazole-5-carboxylic acid ethyl ester Formula: C15H16N4O3S MolecularWeight: 332.37754

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=CN1)NC(=NC(=O)C2=CC=CC=C2)SC

Isomeric SMILES

CCOC(=O)C1=C(N=CN1)NC(=NC(=O)C2=CC=CC=C2)SC

InChI

InChI=1S/C15H16N4O3S/c1-3-22-14(21)11-12(17-9-16-11)18-15(23-2)19-13(20)10-7-5-4-6-8-10/h4-9H,3H2,1-2H3,(H,16,17)(H,18,19,20)