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

Systemtic Name: (2-chloranyl-5-nitro-phenyl)-[2-[(3-methylphenyl)methylsulfanyl]-4,5-dihydroimidazol-1-yl]methanone Openeye Name: (2-chloro-5-nitro-phenyl)-[2-(m-tolylmethylsulfanyl)-4,5-dihydroimidazol-1-yl]methanone CAS Name: (2-chloro-5-nitrophenyl)-[2-[(3-methylphenyl)methylthio]-4,5-dihydroimidazol-1-yl]methanone IUPAC Name: (2-chloro-5-nitrophenyl)-[2-[(3-methylphenyl)methylsulfanyl]-4,5-dihydroimidazol-1-yl]methanone Traditional Name: (2-chloro-5-nitro-phenyl)-[2-[(3-methylbenzyl)thio]-2-imidazolin-1-yl]methanone Formula: C18H16ClN3O3S MolecularWeight: 389.85594

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H16ClN3O3S/c1-12-3-2-4-13(9-12)11-26-18-20-7-8-21(18)17(23)15-10-14(22(24)25)5-6-16(15)19/h2-6,9-10H,7-8,11H2,1H3