3-[(3,4-dichlorophenyl)amino]-1-(4,6-dimethylpyrimidin-2-yl)-6,7-dihydro-5H-indazol-4-one

Systemtic Name: 3-[(3,4-dichlorophenyl)amino]-1-(4,6-dimethylpyrimidin-2-yl)-6,7-dihydro-5H-indazol-4-one Openeye Name: 3-(3,4-dichloroanilino)-1-(4,6-dimethylpyrimidin-2-yl)-6,7-dihydro-5H-indazol-4-one CAS Name: 3-(3,4-dichloroanilino)-1-(4,6-dimethyl-2-pyrimidinyl)-6,7-dihydro-5H-indazol-4-one IUPAC Name: 3-(3,4-dichloroanilino)-1-(4,6-dimethylpyrimidin-2-yl)-6,7-dihydro-5H-indazol-4-one Traditional Name: 3-(3,4-dichloroanilino)-1-(4,6-dimethylpyrimidin-2-yl)-6,7-dihydro-5H-indazol-4-one Formula: C19H17Cl2N5O MolecularWeight: 402.27718

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N2C3=C(C(=O)CCC3)C(=N2)NC4=CC(=C(C=C4)Cl)Cl)C

Isomeric SMILES

CC1=CC(=NC(=N1)N2C3=C(C(=O)CCC3)C(=N2)NC4=CC(=C(C=C4)Cl)Cl)C

InChI

InChI=1S/C19H17Cl2N5O/c1-10-8-11(2)23-19(22-10)26-15-4-3-5-16(27)17(15)18(25-26)24-12-6-7-13(20)14(21)9-12/h6-9H,3-5H2,1-2H3,(H,24,25)