1-(3-azanylindazol-1-yl)-4-(5-phenyl-3,4-dihydropyrazol-2-yl)butane-1,4-dione

Systemtic Name: 1-(3-azanylindazol-1-yl)-4-(5-phenyl-3,4-dihydropyrazol-2-yl)butane-1,4-dione Openeye Name: 1-(3-aminoindazol-1-yl)-4-(5-phenyl-3,4-dihydropyrazol-2-yl)butane-1,4-dione CAS Name: 1-(3-amino-1-indazolyl)-4-(5-phenyl-3,4-dihydropyrazol-2-yl)butane-1,4-dione IUPAC Name: 1-(3-aminoindazol-1-yl)-4-(5-phenyl-3,4-dihydropyrazol-2-yl)butane-1,4-dione Traditional Name: 1-(3-aminoindazol-1-yl)-4-(3-phenyl-2-pyrazolin-1-yl)butane-1,4-dione Formula: C20H19N5O2 MolecularWeight: 361.39716

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(N=C1C2=CC=CC=C2)C(=O)CCC(=O)N3C4=CC=CC=C4C(=N3)N

Isomeric SMILES

C1CN(N=C1C2=CC=CC=C2)C(=O)CCC(=O)N3C4=CC=CC=C4C(=N3)N

InChI

InChI=1S/C20H19N5O2/c21-20-15-8-4-5-9-17(15)25(23-20)19(27)11-10-18(26)24-13-12-16(22-24)14-6-2-1-3-7-14/h1-9H,10-13H2,(H2,21,23)