4-azanyl-2-[2-[2,4-di(propan-2-yl)phenyl]-2-oxidanylidene-ethyl]sulfanyl-pyrimidine-5-carbonitrile

Systemtic Name: 4-azanyl-2-[2-[2,4-di(propan-2-yl)phenyl]-2-oxidanylidene-ethyl]sulfanyl-pyrimidine-5-carbonitrile Openeye Name: 4-amino-2-[2-(2,4-diisopropylphenyl)-2-oxo-ethyl]sulfanyl-pyrimidine-5-carbonitrile CAS Name: 4-amino-2-[[2-[2,4-di(propan-2-yl)phenyl]-2-oxoethyl]thio]-5-pyrimidinecarbonitrile IUPAC Name: 4-amino-2-[2-[2,4-di(propan-2-yl)phenyl]-2-oxoethyl]sulfanylpyrimidine-5-carbonitrile Traditional Name: 4-amino-2-[[2-(2,4-diisopropylphenyl)-2-keto-ethyl]thio]pyrimidine-5-carbonitrile Formula: C19H22N4OS MolecularWeight: 354.46918

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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)C(C)C

Isomeric SMILES

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

InChI

InChI=1S/C19H22N4OS/c1-11(2)13-5-6-15(16(7-13)12(3)4)17(24)10-25-19-22-9-14(8-20)18(21)23-19/h5-7,9,11-12H,10H2,1-4H3,(H2,21,22,23)