1,3-dimethyl-2,4-bis(oxidanylidene)-6-[(1-phenylpyrazol-4-yl)methylamino]pyrimidine-5-carbonitrile

Systemtic Name: 1,3-dimethyl-2,4-bis(oxidanylidene)-6-[(1-phenylpyrazol-4-yl)methylamino]pyrimidine-5-carbonitrile Openeye Name: 1,3-dimethyl-2,4-dioxo-6-[(1-phenylpyrazol-4-yl)methylamino]pyrimidine-5-carbonitrile CAS Name: 1,3-dimethyl-2,4-dioxo-6-[(1-phenyl-4-pyrazolyl)methylamino]-5-pyrimidinecarbonitrile IUPAC Name: 1,3-dimethyl-2,4-dioxo-6-[(1-phenylpyrazol-4-yl)methylamino]pyrimidine-5-carbonitrile Traditional Name: 2,4-diketo-1,3-dimethyl-6-[(1-phenylpyrazol-4-yl)methylamino]pyrimidine-5-carbonitrile Formula: C17H16N6O2 MolecularWeight: 336.34794

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=O)N(C1=O)C)C#N)NCC2=CN(N=C2)C3=CC=CC=C3

Isomeric SMILES

CN1C(=C(C(=O)N(C1=O)C)C#N)NCC2=CN(N=C2)C3=CC=CC=C3

InChI

InChI=1S/C17H16N6O2/c1-21-15(14(8-18)16(24)22(2)17(21)25)19-9-12-10-20-23(11-12)13-6-4-3-5-7-13/h3-7,10-11,19H,9H2,1-2H3