[2-[(3-methylphenyl)methylsulfanyl]-4,5-dihydroimidazol-1-yl]-(4-nitrophenyl)methanone

Systemtic Name: [2-[(3-methylphenyl)methylsulfanyl]-4,5-dihydroimidazol-1-yl]-(4-nitrophenyl)methanone Openeye Name: [2-(m-tolylmethylsulfanyl)-4,5-dihydroimidazol-1-yl]-(4-nitrophenyl)methanone CAS Name: [2-[(3-methylphenyl)methylthio]-4,5-dihydroimidazol-1-yl]-(4-nitrophenyl)methanone IUPAC Name: [2-[(3-methylphenyl)methylsulfanyl]-4,5-dihydroimidazol-1-yl]-(4-nitrophenyl)methanone Traditional Name: [2-[(3-methylbenzyl)thio]-2-imidazolin-1-yl]-(4-nitrophenyl)methanone Formula: C18H17N3O3S MolecularWeight: 355.41088

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CSC2=NCCN2C(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC=C1)CSC2=NCCN2C(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H17N3O3S/c1-13-3-2-4-14(11-13)12-25-18-19-9-10-20(18)17(22)15-5-7-16(8-6-15)21(23)24/h2-8,11H,9-10,12H2,1H3