4-[2-azanyl-6-[(4-azanyl-2-methyl-quinolin-6-yl)amino]pyrimidin-4-yl]benzenecarbonitrile

Systemtic Name: 4-[2-azanyl-6-[(4-azanyl-2-methyl-quinolin-6-yl)amino]pyrimidin-4-yl]benzenecarbonitrile Openeye Name: 4-[2-amino-6-[(4-amino-2-methyl-6-quinolyl)amino]pyrimidin-4-yl]benzonitrile CAS Name: 4-[2-amino-6-[(4-amino-2-methyl-6-quinolinyl)amino]-4-pyrimidinyl]benzonitrile IUPAC Name: 4-[2-amino-6-[(4-amino-2-methylquinolin-6-yl)amino]pyrimidin-4-yl]benzonitrile Traditional Name: 4-[2-amino-6-[(4-amino-2-methyl-6-quinolyl)amino]pyrimidin-4-yl]benzonitrile Formula: C21H17N7 MolecularWeight: 367.40658

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C(C=C2)NC3=NC(=NC(=C3)C4=CC=C(C=C4)C#N)N)C(=C1)N

Isomeric SMILES

CC1=NC2=C(C=C(C=C2)NC3=NC(=NC(=C3)C4=CC=C(C=C4)C#N)N)C(=C1)N

InChI

InChI=1S/C21H17N7/c1-12-8-17(23)16-9-15(6-7-18(16)25-12)26-20-10-19(27-21(24)28-20)14-4-2-13(11-22)3-5-14/h2-10H,1H3,(H2,23,25)(H3,24,26,27,28)