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

Systemtic Name: (4-nitrophenyl)-[2-(pyridin-3-ylmethylsulfanyl)-4,5-dihydroimidazol-1-yl]methanone Openeye Name: (4-nitrophenyl)-[2-(3-pyridylmethylsulfanyl)-4,5-dihydroimidazol-1-yl]methanone CAS Name: (4-nitrophenyl)-[2-(3-pyridinylmethylthio)-4,5-dihydroimidazol-1-yl]methanone IUPAC Name: (4-nitrophenyl)-[2-(pyridin-3-ylmethylsulfanyl)-4,5-dihydroimidazol-1-yl]methanone Traditional Name: (4-nitrophenyl)-[2-(3-pyridylmethylthio)-2-imidazolin-1-yl]methanone Formula: C16H14N4O3S MolecularWeight: 342.37236

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H14N4O3S/c21-15(13-3-5-14(6-4-13)20(22)23)19-9-8-18-16(19)24-11-12-2-1-7-17-10-12/h1-7,10H,8-9,11H2