6-(3-chloranyl-2-methyl-phenyl)-2-(4-nitrophenyl)-1H-imidazo[1,2-a]pyrimidine-5-thione

Systemtic Name: 6-(3-chloranyl-2-methyl-phenyl)-2-(4-nitrophenyl)-1H-imidazo[1,2-a]pyrimidine-5-thione Openeye Name: 6-(3-chloro-2-methyl-phenyl)-2-(4-nitrophenyl)-1H-imidazo[1,2-a]pyrimidine-5-thione CAS Name: 6-(3-chloro-2-methylphenyl)-2-(4-nitrophenyl)-1H-imidazo[1,2-a]pyrimidine-5-thione IUPAC Name: 6-(3-chloro-2-methylphenyl)-2-(4-nitrophenyl)-1H-imidazo[1,2-a]pyrimidine-5-thione Traditional Name: 6-(3-chloro-2-methyl-phenyl)-2-(4-nitrophenyl)-1H-imidazo[1,2-a]pyrimidine-5-thione Formula: C19H13ClN4O2S MolecularWeight: 396.85012

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)C2=CN=C3NC(=CN3C2=S)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC=C1Cl)C2=CN=C3NC(=CN3C2=S)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C19H13ClN4O2S/c1-11-14(3-2-4-16(11)20)15-9-21-19-22-17(10-23(19)18(15)27)12-5-7-13(8-6-12)24(25)26/h2-10H,1H3,(H,21,22)