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

Systemtic Name: 2-[[3-(1-hydroxyethyl)phenyl]amino]-6-(4-methoxyphenyl)-4-oxidanylidene-1H-pyrimidine-5-carbonitrile Openeye Name: 2-[3-(1-hydroxyethyl)anilino]-6-(4-methoxyphenyl)-4-oxo-1H-pyrimidine-5-carbonitrile CAS Name: 2-[3-(1-hydroxyethyl)anilino]-6-(4-methoxyphenyl)-4-oxo-1H-pyrimidine-5-carbonitrile IUPAC Name: 2-[3-(1-hydroxyethyl)anilino]-6-(4-methoxyphenyl)-4-oxo-1H-pyrimidine-5-carbonitrile Traditional Name: 2-[3-(1-hydroxyethyl)anilino]-4-keto-6-(4-methoxyphenyl)-1H-pyrimidine-5-carbonitrile Formula: C20H18N4O3 MolecularWeight: 362.38192

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=CC=C1)NC2=NC(=O)C(=C(N2)C3=CC=C(C=C3)OC)C#N)O

Isomeric SMILES

CC(C1=CC(=CC=C1)NC2=NC(=O)C(=C(N2)C3=CC=C(C=C3)OC)C#N)O

InChI

InChI=1S/C20H18N4O3/c1-12(25)14-4-3-5-15(10-14)22-20-23-18(17(11-21)19(26)24-20)13-6-8-16(27-2)9-7-13/h3-10,12,25H,1-2H3,(H2,22,23,24,26)