2-[3,3-bis(chloranyl)-2-(4-methylphenyl)sulfanyl-1-nitro-prop-2-enylidene]-1,3-dihydrobenzimidazole

Systemtic Name: 2-[3,3-bis(chloranyl)-2-(4-methylphenyl)sulfanyl-1-nitro-prop-2-enylidene]-1,3-dihydrobenzimidazole Openeye Name: 2-[3,3-dichloro-1-nitro-2-(p-tolylsulfanyl)prop-2-enylidene]-1,3-dihydrobenzimidazole CAS Name: 2-[3,3-dichloro-2-[(4-methylphenyl)thio]-1-nitroprop-2-enylidene]-1,3-dihydrobenzimidazole IUPAC Name: 2-[3,3-dichloro-2-(4-methylphenyl)sulfanyl-1-nitroprop-2-enylidene]-1,3-dihydrobenzimidazole Traditional Name: 2-[3,3-dichloro-1-nitro-2-(p-tolylthio)prop-2-enylidene]-1,3-dihydrobenzimidazole Formula: C17H13Cl2N3O2S MolecularWeight: 394.27502

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC(=C(Cl)Cl)C(=C2NC3=CC=CC=C3N2)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)SC(=C(Cl)Cl)C(=C2NC3=CC=CC=C3N2)[N+](=O)[O-]

InChI

InChI=1S/C17H13Cl2N3O2S/c1-10-6-8-11(9-7-10)25-15(16(18)19)14(22(23)24)17-20-12-4-2-3-5-13(12)21-17/h2-9,20-21H,1H3