2-[(4-aminocarbonylphenyl)methylsulfanyl]-3-phenyl-imidazole-4-carboxylate

Systemtic Name: 2-[(4-aminocarbonylphenyl)methylsulfanyl]-3-phenyl-imidazole-4-carboxylate Openeye Name: 2-[(4-carbamoylphenyl)methylsulfanyl]-3-phenyl-imidazole-4-carboxylate CAS Name: 2-[(4-carbamoylphenyl)methylthio]-3-phenyl-4-imidazolecarboxylate IUPAC Name: 2-[(4-carbamoylphenyl)methylsulfanyl]-3-phenylimidazole-4-carboxylate Traditional Name: 2-[(4-carbamoylbenzyl)thio]-3-phenyl-imidazole-4-carboxylate Formula: C18H14N3O3S- MolecularWeight: 352.38706

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=CN=C2SCC3=CC=C(C=C3)C(=O)N)C(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)N2C(=CN=C2SCC3=CC=C(C=C3)C(=O)N)C(=O)[O-]

InChI

InChI=1S/C18H15N3O3S/c19-16(22)13-8-6-12(7-9-13)11-25-18-20-10-15(17(23)24)21(18)14-4-2-1-3-5-14/h1-10H,11H2,(H2,19,22)(H,23,24)/p-1