6-[(1,5-dimethylpyrazol-3-yl)amino]-4-[(2-methyl-1-oxidanylidene-3,4-dihydroisoquinolin-8-yl)amino]pyridine-3-carbonitrile

Systemtic Name: 6-[(1,5-dimethylpyrazol-3-yl)amino]-4-[(2-methyl-1-oxidanylidene-3,4-dihydroisoquinolin-8-yl)amino]pyridine-3-carbonitrile Openeye Name: 6-[(1,5-dimethylpyrazol-3-yl)amino]-4-[(2-methyl-1-oxo-3,4-dihydroisoquinolin-8-yl)amino]pyridine-3-carbonitrile CAS Name: 6-[(1,5-dimethyl-3-pyrazolyl)amino]-4-[(2-methyl-1-oxo-3,4-dihydroisoquinolin-8-yl)amino]-3-pyridinecarbonitrile IUPAC Name: 6-[(1,5-dimethylpyrazol-3-yl)amino]-4-[(2-methyl-1-oxo-3,4-dihydroisoquinolin-8-yl)amino]pyridine-3-carbonitrile Traditional Name: 6-[(1,5-dimethylpyrazol-3-yl)amino]-4-[(1-keto-2-methyl-3,4-dihydroisoquinolin-8-yl)amino]nicotinonitrile Formula: C21H21N7O MolecularWeight: 387.43774

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C)NC2=NC=C(C(=C2)NC3=CC=CC4=C3C(=O)N(CC4)C)C#N

Isomeric SMILES

CC1=CC(=NN1C)NC2=NC=C(C(=C2)NC3=CC=CC4=C3C(=O)N(CC4)C)C#N

InChI

InChI=1S/C21H21N7O/c1-13-9-19(26-28(13)3)25-18-10-17(15(11-22)12-23-18)24-16-6-4-5-14-7-8-27(2)21(29)20(14)16/h4-6,9-10,12H,7-8H2,1-3H3,(H2,23,24,25,26)