2-(4-nitrophenyl)sulfanyl-1-(phenylmethyl)imidazole hydrochloride

Systemtic Name: 2-(4-nitrophenyl)sulfanyl-1-(phenylmethyl)imidazole hydrochloride Openeye Name: 1-benzyl-2-(4-nitrophenyl)sulfanyl-imidazole hydrochloride CAS Name: 2-[(4-nitrophenyl)thio]-1-(phenylmethyl)imidazole hydrochloride IUPAC Name: 1-benzyl-2-(4-nitrophenyl)sulfanylimidazole hydrochloride Traditional Name: 1-benzyl-2-[(4-nitrophenyl)thio]imidazole hydrochloride Formula: C16H14ClN3O2S MolecularWeight: 347.81926

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=CN=C2SC3=CC=C(C=C3)[N+](=O)[O-].Cl

Isomeric SMILES

C1=CC=C(C=C1)CN2C=CN=C2SC3=CC=C(C=C3)[N+](=O)[O-].Cl

InChI

InChI=1S/C16H13N3O2S.ClH/c20-19(21)14-6-8-15(9-7-14)22-16-17-10-11-18(16)12-13-4-2-1-3-5-13;/h1-11H,12H2;1H