4-(4-tert-butylphenyl)-2-methylsulfanyl-6-(2-oxidanylpropylamino)pyrimidine-5-carbonitrile

Systemtic Name: 4-(4-tert-butylphenyl)-2-methylsulfanyl-6-(2-oxidanylpropylamino)pyrimidine-5-carbonitrile Openeye Name: 4-(4-tert-butylphenyl)-6-(2-hydroxypropylamino)-2-methylsulfanyl-pyrimidine-5-carbonitrile CAS Name: 4-(4-tert-butylphenyl)-6-(2-hydroxypropylamino)-2-(methylthio)-5-pyrimidinecarbonitrile IUPAC Name: 4-(4-tert-butylphenyl)-6-(2-hydroxypropylamino)-2-methylsulfanylpyrimidine-5-carbonitrile Traditional Name: 4-(4-tert-butylphenyl)-6-(2-hydroxypropylamino)-2-(methylthio)pyrimidine-5-carbonitrile Formula: C19H24N4OS MolecularWeight: 356.48506

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC1=NC(=NC(=C1C#N)C2=CC=C(C=C2)C(C)(C)C)SC)O

Isomeric SMILES

CC(CNC1=NC(=NC(=C1C#N)C2=CC=C(C=C2)C(C)(C)C)SC)O

InChI

InChI=1S/C19H24N4OS/c1-12(24)11-21-17-15(10-20)16(22-18(23-17)25-5)13-6-8-14(9-7-13)19(2,3)4/h6-9,12,24H,11H2,1-5H3,(H,21,22,23)