6,6-dimethyl-3-(naphthalen-2-ylamino)-1-pyrimidin-2-yl-5,7-dihydroindazol-4-one

Systemtic Name: 6,6-dimethyl-3-(naphthalen-2-ylamino)-1-pyrimidin-2-yl-5,7-dihydroindazol-4-one Openeye Name: 6,6-dimethyl-3-(2-naphthylamino)-1-pyrimidin-2-yl-5,7-dihydroindazol-4-one CAS Name: 6,6-dimethyl-3-(2-naphthalenylamino)-1-(2-pyrimidinyl)-5,7-dihydroindazol-4-one IUPAC Name: 6,6-dimethyl-3-(naphthalen-2-ylamino)-1-pyrimidin-2-yl-5,7-dihydroindazol-4-one Traditional Name: 6,6-dimethyl-3-(2-naphthylamino)-1-(2-pyrimidyl)-5,7-dihydroindazol-4-one Formula: C23H21N5O MolecularWeight: 383.44574

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(=O)C1)C(=NN2C3=NC=CC=N3)NC4=CC5=CC=CC=C5C=C4)C

Isomeric SMILES

CC1(CC2=C(C(=O)C1)C(=NN2C3=NC=CC=N3)NC4=CC5=CC=CC=C5C=C4)C

InChI

InChI=1S/C23H21N5O/c1-23(2)13-18-20(19(29)14-23)21(27-28(18)22-24-10-5-11-25-22)26-17-9-8-15-6-3-4-7-16(15)12-17/h3-12H,13-14H2,1-2H3,(H,26,27)