2-[4,5-dimethyl-6-[(5-propan-2-yl-1H-1,2,4-triazol-3-yl)amino]pyrimidin-2-yl]benzenecarbonitrile

Systemtic Name: 2-[4,5-dimethyl-6-[(5-propan-2-yl-1H-1,2,4-triazol-3-yl)amino]pyrimidin-2-yl]benzenecarbonitrile Openeye Name: 2-[4-[(5-isopropyl-1H-1,2,4-triazol-3-yl)amino]-5,6-dimethyl-pyrimidin-2-yl]benzonitrile CAS Name: 2-[4,5-dimethyl-6-[(5-propan-2-yl-1H-1,2,4-triazol-3-yl)amino]-2-pyrimidinyl]benzonitrile IUPAC Name: 2-[4,5-dimethyl-6-[(5-propan-2-yl-1H-1,2,4-triazol-3-yl)amino]pyrimidin-2-yl]benzonitrile Traditional Name: 2-[4-[(5-isopropyl-1H-1,2,4-triazol-3-yl)amino]-5,6-dimethyl-pyrimidin-2-yl]benzonitrile Formula: C18H19N7 MolecularWeight: 333.39036

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(N=C1NC2=NNC(=N2)C(C)C)C3=CC=CC=C3C#N)C

Isomeric SMILES

CC1=C(N=C(N=C1NC2=NNC(=N2)C(C)C)C3=CC=CC=C3C#N)C

InChI

InChI=1S/C18H19N7/c1-10(2)15-22-18(25-24-15)23-16-11(3)12(4)20-17(21-16)14-8-6-5-7-13(14)9-19/h5-8,10H,1-4H3,(H2,20,21,22,23,24,25)