2-(4,5-dihydro-1H-imidazol-2-ylsulfanyl)-N-(3-nitrophenyl)ethanamide hydrochloride

Systemtic Name: 2-(4,5-dihydro-1H-imidazol-2-ylsulfanyl)-N-(3-nitrophenyl)ethanamide hydrochloride Openeye Name: 2-(4,5-dihydro-1H-imidazol-2-ylsulfanyl)-N-(3-nitrophenyl)acetamide hydrochloride CAS Name: 2-(4,5-dihydro-1H-imidazol-2-ylthio)-N-(3-nitrophenyl)acetamide hydrochloride IUPAC Name: 2-(4,5-dihydro-1H-imidazol-2-ylsulfanyl)-N-(3-nitrophenyl)acetamide hydrochloride Traditional Name: 2-(2-imidazolin-2-ylthio)-N-(3-nitrophenyl)acetamide hydrochloride Formula: C11H13ClN4O3S MolecularWeight: 316.76392

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Descriptors Computed from Structure

Canonical SMILES:

C1CN=C(N1)SCC(=O)NC2=CC(=CC=C2)[N+](=O)[O-].Cl

Isomeric SMILES

C1CN=C(N1)SCC(=O)NC2=CC(=CC=C2)[N+](=O)[O-].Cl

InChI

InChI=1S/C11H12N4O3S.ClH/c16-10(7-19-11-12-4-5-13-11)14-8-2-1-3-9(6-8)15(17)18;/h1-3,6H,4-5,7H2,(H,12,13)(H,14,16);1H