4-(1,3-benzodioxol-5-yl)-2-(3,5-dimethylpyrazol-1-yl)-1-methyl-6-oxidanylidene-pyrimidine-5-carbonitrile

Systemtic Name: 4-(1,3-benzodioxol-5-yl)-2-(3,5-dimethylpyrazol-1-yl)-1-methyl-6-oxidanylidene-pyrimidine-5-carbonitrile Openeye Name: 4-(1,3-benzodioxol-5-yl)-2-(3,5-dimethylpyrazol-1-yl)-1-methyl-6-oxo-pyrimidine-5-carbonitrile CAS Name: 4-(1,3-benzodioxol-5-yl)-2-(3,5-dimethyl-1-pyrazolyl)-1-methyl-6-oxo-5-pyrimidinecarbonitrile IUPAC Name: 4-(1,3-benzodioxol-5-yl)-2-(3,5-dimethylpyrazol-1-yl)-1-methyl-6-oxopyrimidine-5-carbonitrile Traditional Name: 4-(1,3-benzodioxol-5-yl)-2-(3,5-dimethylpyrazol-1-yl)-6-keto-1-methyl-pyrimidine-5-carbonitrile Formula: C18H15N5O3 MolecularWeight: 349.3434

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=NC(=C(C(=O)N2C)C#N)C3=CC4=C(C=C3)OCO4)C

Isomeric SMILES

CC1=CC(=NN1C2=NC(=C(C(=O)N2C)C#N)C3=CC4=C(C=C3)OCO4)C

InChI

InChI=1S/C18H15N5O3/c1-10-6-11(2)23(21-10)18-20-16(13(8-19)17(24)22(18)3)12-4-5-14-15(7-12)26-9-25-14/h4-7H,9H2,1-3H3