4-azanyl-2-[(2S)-1-(4-methylphenyl)-1-oxidanylidene-propan-2-yl]sulfanyl-pyrimidine-5-carbonitrile

Systemtic Name: 4-azanyl-2-[(2S)-1-(4-methylphenyl)-1-oxidanylidene-propan-2-yl]sulfanyl-pyrimidine-5-carbonitrile Openeye Name: 4-amino-2-[(1S)-1-methyl-2-oxo-2-(p-tolyl)ethyl]sulfanyl-pyrimidine-5-carbonitrile CAS Name: 4-amino-2-[[(2S)-1-(4-methylphenyl)-1-oxopropan-2-yl]thio]-5-pyrimidinecarbonitrile IUPAC Name: 4-amino-2-[(2S)-1-(4-methylphenyl)-1-oxopropan-2-yl]sulfanylpyrimidine-5-carbonitrile Traditional Name: 4-amino-2-[[(1S)-2-keto-1-methyl-2-(p-tolyl)ethyl]thio]pyrimidine-5-carbonitrile Formula: C15H14N4OS MolecularWeight: 298.36286

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C(C)SC2=NC=C(C(=N2)N)C#N

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)[C@H](C)SC2=NC=C(C(=N2)N)C#N

InChI

InChI=1S/C15H14N4OS/c1-9-3-5-11(6-4-9)13(20)10(2)21-15-18-8-12(7-16)14(17)19-15/h3-6,8,10H,1-2H3,(H2,17,18,19)/t10-/m0/s1