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

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-6-(3-chloranyl-4-methyl-phenyl)-1H-imidazo[1,2-a]pyrimidine-5-thione Openeye Name: 2-(1,3-benzodioxol-5-yl)-6-(3-chloro-4-methyl-phenyl)-1H-imidazo[1,2-a]pyrimidine-5-thione CAS Name: 2-(1,3-benzodioxol-5-yl)-6-(3-chloro-4-methylphenyl)-1H-imidazo[1,2-a]pyrimidine-5-thione IUPAC Name: 2-(1,3-benzodioxol-5-yl)-6-(3-chloro-4-methylphenyl)-1H-imidazo[1,2-a]pyrimidine-5-thione Traditional Name: 2-(1,3-benzodioxol-5-yl)-6-(3-chloro-4-methyl-phenyl)-1H-imidazo[1,2-a]pyrimidine-5-thione Formula: C20H14ClN3O2S MolecularWeight: 395.86206

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=CN=C3NC(=CN3C2=S)C4=CC5=C(C=C4)OCO5)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)C2=CN=C3NC(=CN3C2=S)C4=CC5=C(C=C4)OCO5)Cl

InChI

InChI=1S/C20H14ClN3O2S/c1-11-2-3-12(6-15(11)21)14-8-22-20-23-16(9-24(20)19(14)27)13-4-5-17-18(7-13)26-10-25-17/h2-9H,10H2,1H3,(H,22,23)