4-azanyl-2-[2-oxidanylidene-2-(4-propan-2-ylphenyl)ethyl]sulfanyl-pyrimidine-5-carbonitrile

Systemtic Name: 4-azanyl-2-[2-oxidanylidene-2-(4-propan-2-ylphenyl)ethyl]sulfanyl-pyrimidine-5-carbonitrile Openeye Name: 4-amino-2-[2-(4-isopropylphenyl)-2-oxo-ethyl]sulfanyl-pyrimidine-5-carbonitrile CAS Name: 4-amino-2-[[2-oxo-2-(4-propan-2-ylphenyl)ethyl]thio]-5-pyrimidinecarbonitrile IUPAC Name: 4-amino-2-[2-oxo-2-(4-propan-2-ylphenyl)ethyl]sulfanylpyrimidine-5-carbonitrile Traditional Name: 4-amino-2-[(2-keto-2-p-cumenyl-ethyl)thio]pyrimidine-5-carbonitrile Formula: C16H16N4OS MolecularWeight: 312.38944

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C(=O)CSC2=NC=C(C(=N2)N)C#N

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C(=O)CSC2=NC=C(C(=N2)N)C#N

InChI

InChI=1S/C16H16N4OS/c1-10(2)11-3-5-12(6-4-11)14(21)9-22-16-19-8-13(7-17)15(18)20-16/h3-6,8,10H,9H2,1-2H3,(H2,18,19,20)