2-azanyl-4-[(3,4-dimethylphenyl)methylamino]-6-pyridin-3-yl-pyrimidine-5-carbonitrile

Systemtic Name: 2-azanyl-4-[(3,4-dimethylphenyl)methylamino]-6-pyridin-3-yl-pyrimidine-5-carbonitrile Openeye Name: 2-amino-4-[(3,4-dimethylphenyl)methylamino]-6-(3-pyridyl)pyrimidine-5-carbonitrile CAS Name: 2-amino-4-[(3,4-dimethylphenyl)methylamino]-6-(3-pyridinyl)-5-pyrimidinecarbonitrile IUPAC Name: 2-amino-4-[(3,4-dimethylphenyl)methylamino]-6-pyridin-3-ylpyrimidine-5-carbonitrile Traditional Name: 2-amino-4-[(3,4-dimethylbenzyl)amino]-6-(3-pyridyl)pyrimidine-5-carbonitrile Formula: C19H18N6 MolecularWeight: 330.38642

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CNC2=NC(=NC(=C2C#N)C3=CN=CC=C3)N)C

Isomeric SMILES

CC1=C(C=C(C=C1)CNC2=NC(=NC(=C2C#N)C3=CN=CC=C3)N)C

InChI

InChI=1S/C19H18N6/c1-12-5-6-14(8-13(12)2)10-23-18-16(9-20)17(24-19(21)25-18)15-4-3-7-22-11-15/h3-8,11H,10H2,1-2H3,(H3,21,23,24,25)