2-[(4-ethoxy-3-nitro-phenyl)methylsulfanyl]-4,5-dihydro-1H-imidazole hydrochloride

Systemtic Name: 2-[(4-ethoxy-3-nitro-phenyl)methylsulfanyl]-4,5-dihydro-1H-imidazole hydrochloride Openeye Name: 2-[(4-ethoxy-3-nitro-phenyl)methylsulfanyl]-4,5-dihydro-1H-imidazole hydrochloride CAS Name: 2-[(4-ethoxy-3-nitrophenyl)methylthio]-4,5-dihydro-1H-imidazole hydrochloride IUPAC Name: 2-[(4-ethoxy-3-nitrophenyl)methylsulfanyl]-4,5-dihydro-1H-imidazole hydrochloride Traditional Name: 2-[(4-ethoxy-3-nitro-benzyl)thio]-2-imidazoline hydrochloride Formula: C12H16ClN3O3S MolecularWeight: 317.79174

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CSC2=NCCN2)[N+](=O)[O-].Cl

Isomeric SMILES

CCOC1=C(C=C(C=C1)CSC2=NCCN2)[N+](=O)[O-].Cl

InChI

InChI=1S/C12H15N3O3S.ClH/c1-2-18-11-4-3-9(7-10(11)15(16)17)8-19-12-13-5-6-14-12;/h3-4,7H,2,5-6,8H2,1H3,(H,13,14);1H