3-[[5-azanyl-6-[ethyl(phenyl)amino]pyrimidin-4-yl]-(2-cyanoethyl)amino]propanenitrile

Systemtic Name: 3-[[5-azanyl-6-[ethyl(phenyl)amino]pyrimidin-4-yl]-(2-cyanoethyl)amino]propanenitrile Openeye Name: 3-[[5-amino-6-(N-ethylanilino)pyrimidin-4-yl]-(2-cyanoethyl)amino]propanenitrile CAS Name: 3-[[5-amino-6-(N-ethylanilino)-4-pyrimidinyl]-(2-cyanoethyl)amino]propanenitrile IUPAC Name: 3-[[5-amino-6-(N-ethylanilino)pyrimidin-4-yl]-(2-cyanoethyl)amino]propanenitrile Traditional Name: 3-[[5-amino-6-(N-ethylanilino)pyrimidin-4-yl]-(2-cyanoethyl)amino]propionitrile Formula: C18H21N7 MolecularWeight: 335.40624

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC=C1)C2=C(C(=NC=N2)N(CCC#N)CCC#N)N

Isomeric SMILES

CCN(C1=CC=CC=C1)C2=C(C(=NC=N2)N(CCC#N)CCC#N)N

InChI

InChI=1S/C18H21N7/c1-2-25(15-8-4-3-5-9-15)18-16(21)17(22-14-23-18)24(12-6-10-19)13-7-11-20/h3-5,8-9,14H,2,6-7,12-13,21H2,1H3