2-[[3-(hydroxymethyl)phenyl]amino]-6-(4-methoxyphenyl)-4-oxidanylidene-1H-pyrimidine-5-carbonitrile

Systemtic Name: 2-[[3-(hydroxymethyl)phenyl]amino]-6-(4-methoxyphenyl)-4-oxidanylidene-1H-pyrimidine-5-carbonitrile Openeye Name: 2-[3-(hydroxymethyl)anilino]-6-(4-methoxyphenyl)-4-oxo-1H-pyrimidine-5-carbonitrile CAS Name: 2-[3-(hydroxymethyl)anilino]-6-(4-methoxyphenyl)-4-oxo-1H-pyrimidine-5-carbonitrile IUPAC Name: 2-[3-(hydroxymethyl)anilino]-6-(4-methoxyphenyl)-4-oxo-1H-pyrimidine-5-carbonitrile Traditional Name: 4-keto-6-(4-methoxyphenyl)-2-(3-methylolanilino)-1H-pyrimidine-5-carbonitrile Formula: C19H16N4O3 MolecularWeight: 348.35534

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=C(C(=O)N=C(N2)NC3=CC=CC(=C3)CO)C#N

Isomeric SMILES

COC1=CC=C(C=C1)C2=C(C(=O)N=C(N2)NC3=CC=CC(=C3)CO)C#N

InChI

InChI=1S/C19H16N4O3/c1-26-15-7-5-13(6-8-15)17-16(10-20)18(25)23-19(22-17)21-14-4-2-3-12(9-14)11-24/h2-9,24H,11H2,1H3,(H2,21,22,23,25)