2-(butylamino)-6-(4-dimethylaminophenyl)-4-oxidanylidene-1H-pyrimidine-5-carbonitrile

Systemtic Name: 2-(butylamino)-6-(4-dimethylaminophenyl)-4-oxidanylidene-1H-pyrimidine-5-carbonitrile Openeye Name: 2-(butylamino)-6-(4-dimethylaminophenyl)-4-oxo-1H-pyrimidine-5-carbonitrile CAS Name: 2-(butylamino)-6-(4-dimethylaminophenyl)-4-oxo-1H-pyrimidine-5-carbonitrile IUPAC Name: 2-(butylamino)-6-(4-dimethylaminophenyl)-4-oxo-1H-pyrimidine-5-carbonitrile Traditional Name: 2-(butylamino)-6-(4-dimethylaminophenyl)-4-keto-1H-pyrimidine-5-carbonitrile Formula: C17H21N5O MolecularWeight: 311.38154

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=NC(=O)C(=C(N1)C2=CC=C(C=C2)N(C)C)C#N

Isomeric SMILES

CCCCNC1=NC(=O)C(=C(N1)C2=CC=C(C=C2)N(C)C)C#N

InChI

InChI=1S/C17H21N5O/c1-4-5-10-19-17-20-15(14(11-18)16(23)21-17)12-6-8-13(9-7-12)22(2)3/h6-9H,4-5,10H2,1-3H3,(H2,19,20,21,23)