3-[[5-azanyl-6-(2,3-dihydroindol-1-yl)pyrimidin-4-yl]-(2-cyanoethyl)amino]propanenitrile

Systemtic Name: 3-[[5-azanyl-6-(2,3-dihydroindol-1-yl)pyrimidin-4-yl]-(2-cyanoethyl)amino]propanenitrile Openeye Name: 3-[(5-amino-6-indolin-1-yl-pyrimidin-4-yl)-(2-cyanoethyl)amino]propanenitrile CAS Name: 3-[[5-amino-6-(2,3-dihydroindol-1-yl)-4-pyrimidinyl]-(2-cyanoethyl)amino]propanenitrile IUPAC Name: 3-[[5-amino-6-(2,3-dihydroindol-1-yl)pyrimidin-4-yl]-(2-cyanoethyl)amino]propanenitrile Traditional Name: 3-[(5-amino-6-indolin-1-yl-pyrimidin-4-yl)-(2-cyanoethyl)amino]propionitrile Formula: C18H19N7 MolecularWeight: 333.39036

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=CC=CC=C21)C3=C(C(=NC=N3)N(CCC#N)CCC#N)N

Isomeric SMILES

C1CN(C2=CC=CC=C21)C3=C(C(=NC=N3)N(CCC#N)CCC#N)N

InChI

InChI=1S/C18H19N7/c19-8-3-10-24(11-4-9-20)17-16(21)18(23-13-22-17)25-12-7-14-5-1-2-6-15(14)25/h1-2,5-6,13H,3-4,7,10-12,21H2