1-cyclopropyl-2-(4-methylsulfonyl-2-nitro-phenyl)sulfanyl-5-phenyl-imidazole

Systemtic Name: 1-cyclopropyl-2-(4-methylsulfonyl-2-nitro-phenyl)sulfanyl-5-phenyl-imidazole Openeye Name: 1-cyclopropyl-2-(4-methylsulfonyl-2-nitro-phenyl)sulfanyl-5-phenyl-imidazole CAS Name: 1-cyclopropyl-2-[(4-methylsulfonyl-2-nitrophenyl)thio]-5-phenylimidazole IUPAC Name: 1-cyclopropyl-2-(4-methylsulfonyl-2-nitrophenyl)sulfanyl-5-phenylimidazole Traditional Name: 1-cyclopropyl-2-[(4-mesyl-2-nitro-phenyl)thio]-5-phenyl-imidazole Formula: C19H17N3O4S2 MolecularWeight: 415.48598

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)SC2=NC=C(N2C3CC3)C4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)SC2=NC=C(N2C3CC3)C4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C19H17N3O4S2/c1-28(25,26)15-9-10-18(16(11-15)22(23)24)27-19-20-12-17(21(19)14-7-8-14)13-5-3-2-4-6-13/h2-6,9-12,14H,7-8H2,1H3