N-(4-butylphenyl)-2-(4-methyl-6-oxidanylidene-2-phenethylsulfanyl-pyrimidin-1-yl)ethanamide

Systemtic Name: N-(4-butylphenyl)-2-(4-methyl-6-oxidanylidene-2-phenethylsulfanyl-pyrimidin-1-yl)ethanamide Openeye Name: N-(4-butylphenyl)-2-(4-methyl-6-oxo-2-phenethylsulfanyl-pyrimidin-1-yl)acetamide CAS Name: N-(4-butylphenyl)-2-[4-methyl-6-oxo-2-(phenethylthio)-1-pyrimidinyl]acetamide IUPAC Name: N-(4-butylphenyl)-2-(4-methyl-6-oxo-2-phenethylsulfanylpyrimidin-1-yl)acetamide Traditional Name: N-(4-butylphenyl)-2-[6-keto-4-methyl-2-(phenethylthio)pyrimidin-1-yl]acetamide Formula: C25H29N3O2S MolecularWeight: 435.58166

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)CN2C(=O)C=C(N=C2SCCC3=CC=CC=C3)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)CN2C(=O)C=C(N=C2SCCC3=CC=CC=C3)C

InChI

InChI=1S/C25H29N3O2S/c1-3-4-8-21-11-13-22(14-12-21)27-23(29)18-28-24(30)17-19(2)26-25(28)31-16-15-20-9-6-5-7-10-20/h5-7,9-14,17H,3-4,8,15-16,18H2,1-2H3,(H,27,29)