4-[(2-methoxyphenyl)methylamino]-2-methylsulfanyl-6-phenyl-pyrimidine-5-carbonitrile

Systemtic Name: 4-[(2-methoxyphenyl)methylamino]-2-methylsulfanyl-6-phenyl-pyrimidine-5-carbonitrile Openeye Name: 4-[(2-methoxyphenyl)methylamino]-2-methylsulfanyl-6-phenyl-pyrimidine-5-carbonitrile CAS Name: 4-[(2-methoxyphenyl)methylamino]-2-(methylthio)-6-phenyl-5-pyrimidinecarbonitrile IUPAC Name: 4-[(2-methoxyphenyl)methylamino]-2-methylsulfanyl-6-phenylpyrimidine-5-carbonitrile Traditional Name: 2-(methylthio)-4-(o-anisylamino)-6-phenyl-pyrimidine-5-carbonitrile Formula: C20H18N4OS MolecularWeight: 362.44812

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CNC2=NC(=NC(=C2C#N)C3=CC=CC=C3)SC

Isomeric SMILES

COC1=CC=CC=C1CNC2=NC(=NC(=C2C#N)C3=CC=CC=C3)SC

InChI

InChI=1S/C20H18N4OS/c1-25-17-11-7-6-10-15(17)13-22-19-16(12-21)18(23-20(24-19)26-2)14-8-4-3-5-9-14/h3-11H,13H2,1-2H3,(H,22,23,24)