4-[(4-ethoxyphenyl)amino]-2-methylsulfanyl-6-phenyl-pyrimidine-5-carbonitrile

Systemtic Name: 4-[(4-ethoxyphenyl)amino]-2-methylsulfanyl-6-phenyl-pyrimidine-5-carbonitrile Openeye Name: 4-(4-ethoxyanilino)-2-methylsulfanyl-6-phenyl-pyrimidine-5-carbonitrile CAS Name: 4-(4-ethoxyanilino)-2-(methylthio)-6-phenyl-5-pyrimidinecarbonitrile IUPAC Name: 4-(4-ethoxyanilino)-2-methylsulfanyl-6-phenylpyrimidine-5-carbonitrile Traditional Name: 2-(methylthio)-4-phenyl-6-(p-phenetidino)pyrimidine-5-carbonitrile Formula: C20H18N4OS MolecularWeight: 362.44812

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC2=NC(=NC(=C2C#N)C3=CC=CC=C3)SC

Isomeric SMILES

CCOC1=CC=C(C=C1)NC2=NC(=NC(=C2C#N)C3=CC=CC=C3)SC

InChI

InChI=1S/C20H18N4OS/c1-3-25-16-11-9-15(10-12-16)22-19-17(13-21)18(23-20(24-19)26-2)14-7-5-4-6-8-14/h4-12H,3H2,1-2H3,(H,22,23,24)