phenyl 2-(phenylmethylsulfanyl)-4,5-dihydroimidazole-1-carboxylate

Systemtic Name: phenyl 2-(phenylmethylsulfanyl)-4,5-dihydroimidazole-1-carboxylate Openeye Name: phenyl 2-benzylsulfanyl-4,5-dihydroimidazole-1-carboxylate CAS Name: 2-(phenylmethylthio)-4,5-dihydroimidazole-1-carboxylic acid phenyl ester IUPAC Name: phenyl 2-benzylsulfanyl-4,5-dihydroimidazole-1-carboxylate Traditional Name: 2-(benzylthio)-2-imidazoline-1-carboxylic acid phenyl ester Formula: C17H16N2O2S MolecularWeight: 312.38614

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=N1)SCC2=CC=CC=C2)C(=O)OC3=CC=CC=C3

Isomeric SMILES

C1CN(C(=N1)SCC2=CC=CC=C2)C(=O)OC3=CC=CC=C3

InChI

InChI=1S/C17H16N2O2S/c20-17(21-15-9-5-2-6-10-15)19-12-11-18-16(19)22-13-14-7-3-1-4-8-14/h1-10H,11-13H2