1,3-dimethyl-2,4-bis(oxidanylidene)-6-[[1-(phenylmethyl)pyrazol-4-yl]amino]pyrimidine-5-carbonitrile

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

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=O)N(C1=O)C)C#N)NC2=CN(N=C2)CC3=CC=CC=C3

Isomeric SMILES

CN1C(=C(C(=O)N(C1=O)C)C#N)NC2=CN(N=C2)CC3=CC=CC=C3

InChI

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