(4-chloranyl-3-nitro-phenyl)-[2-(pyridin-3-ylmethylsulfanyl)-4,5-dihydroimidazol-1-yl]methanone

Systemtic Name: (4-chloranyl-3-nitro-phenyl)-[2-(pyridin-3-ylmethylsulfanyl)-4,5-dihydroimidazol-1-yl]methanone Openeye Name: (4-chloro-3-nitro-phenyl)-[2-(3-pyridylmethylsulfanyl)-4,5-dihydroimidazol-1-yl]methanone CAS Name: (4-chloro-3-nitrophenyl)-[2-(3-pyridinylmethylthio)-4,5-dihydroimidazol-1-yl]methanone IUPAC Name: (4-chloro-3-nitrophenyl)-[2-(pyridin-3-ylmethylsulfanyl)-4,5-dihydroimidazol-1-yl]methanone Traditional Name: (4-chloro-3-nitro-phenyl)-[2-(3-pyridylmethylthio)-2-imidazolin-1-yl]methanone Formula: C16H13ClN4O3S MolecularWeight: 376.81742

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=N1)SCC2=CN=CC=C2)C(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

C1CN(C(=N1)SCC2=CN=CC=C2)C(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C16H13ClN4O3S/c17-13-4-3-12(8-14(13)21(23)24)15(22)20-7-6-19-16(20)25-10-11-2-1-5-18-9-11/h1-5,8-9H,6-7,10H2