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

Systemtic Name: 6-[(1,3-dimethylpyrazol-4-yl)amino]-4-[(2-methyl-1-oxidanylidene-3,4-dihydroisoquinolin-8-yl)amino]pyridine-3-carbonitrile Openeye Name: 6-[(1,3-dimethylpyrazol-4-yl)amino]-4-[(2-methyl-1-oxo-3,4-dihydroisoquinolin-8-yl)amino]pyridine-3-carbonitrile CAS Name: 6-[(1,3-dimethyl-4-pyrazolyl)amino]-4-[(2-methyl-1-oxo-3,4-dihydroisoquinolin-8-yl)amino]-3-pyridinecarbonitrile IUPAC Name: 6-[(1,3-dimethylpyrazol-4-yl)amino]-4-[(2-methyl-1-oxo-3,4-dihydroisoquinolin-8-yl)amino]pyridine-3-carbonitrile Traditional Name: 6-[(1,3-dimethylpyrazol-4-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=NN(C=C1NC2=NC=C(C(=C2)NC3=CC=CC4=C3C(=O)N(CC4)C)C#N)C

Isomeric SMILES

CC1=NN(C=C1NC2=NC=C(C(=C2)NC3=CC=CC4=C3C(=O)N(CC4)C)C#N)C

InChI

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