2-[[5-azanyl-6-[(3-methoxyphenyl)amino]pyrimidin-4-yl]-(cyanomethyl)amino]ethanenitrile

Systemtic Name: 2-[[5-azanyl-6-[(3-methoxyphenyl)amino]pyrimidin-4-yl]-(cyanomethyl)amino]ethanenitrile Openeye Name: 2-[[5-amino-6-(3-methoxyanilino)pyrimidin-4-yl]-(cyanomethyl)amino]acetonitrile CAS Name: 2-[[5-amino-6-(3-methoxyanilino)-4-pyrimidinyl]-(cyanomethyl)amino]acetonitrile IUPAC Name: 2-[[5-amino-6-(3-methoxyanilino)pyrimidin-4-yl]-(cyanomethyl)amino]acetonitrile Traditional Name: 2-[[5-amino-6-(m-anisidino)pyrimidin-4-yl]-(cyanomethyl)amino]acetonitrile Formula: C15H15N7O MolecularWeight: 309.3259

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC2=C(C(=NC=N2)N(CC#N)CC#N)N

Isomeric SMILES

COC1=CC=CC(=C1)NC2=C(C(=NC=N2)N(CC#N)CC#N)N

InChI

InChI=1S/C15H15N7O/c1-23-12-4-2-3-11(9-12)21-14-13(18)15(20-10-19-14)22(7-5-16)8-6-17/h2-4,9-10H,7-8,18H2,1H3,(H,19,20,21)