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

Systemtic Name: 2-[[5-azanyl-6-(2,3-dihydroindol-1-yl)pyrimidin-4-yl]-(cyanomethyl)amino]ethanenitrile Openeye Name: 2-[(5-amino-6-indolin-1-yl-pyrimidin-4-yl)-(cyanomethyl)amino]acetonitrile CAS Name: 2-[[5-amino-6-(2,3-dihydroindol-1-yl)-4-pyrimidinyl]-(cyanomethyl)amino]acetonitrile IUPAC Name: 2-[[5-amino-6-(2,3-dihydroindol-1-yl)pyrimidin-4-yl]-(cyanomethyl)amino]acetonitrile Traditional Name: 2-[(5-amino-6-indolin-1-yl-pyrimidin-4-yl)-(cyanomethyl)amino]acetonitrile Formula: C16H15N7 MolecularWeight: 305.3372

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H15N7/c17-6-9-22(10-7-18)15-14(19)16(21-11-20-15)23-8-5-12-3-1-2-4-13(12)23/h1-4,11H,5,8-10,19H2