3-[6-methyl-4-oxidanylidene-2-(phenylmethylsulfanyl)-1H-pyrimidin-5-yl]-N-[2-(phenylmethyl)phenyl]propanamide

Systemtic Name: 3-[6-methyl-4-oxidanylidene-2-(phenylmethylsulfanyl)-1H-pyrimidin-5-yl]-N-[2-(phenylmethyl)phenyl]propanamide Openeye Name: N-(2-benzylphenyl)-3-(2-benzylsulfanyl-6-methyl-4-oxo-1H-pyrimidin-5-yl)propanamide CAS Name: 3-[6-methyl-4-oxo-2-(phenylmethylthio)-1H-pyrimidin-5-yl]-N-[2-(phenylmethyl)phenyl]propanamide IUPAC Name: N-(2-benzylphenyl)-3-(2-benzylsulfanyl-6-methyl-4-oxo-1H-pyrimidin-5-yl)propanamide Traditional Name: N-(2-benzylphenyl)-3-[2-(benzylthio)-4-keto-6-methyl-1H-pyrimidin-5-yl]propionamide Formula: C28H27N3O2S MolecularWeight: 469.59788

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)SCC2=CC=CC=C2)CCC(=O)NC3=CC=CC=C3CC4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=O)N=C(N1)SCC2=CC=CC=C2)CCC(=O)NC3=CC=CC=C3CC4=CC=CC=C4

InChI

InChI=1S/C28H27N3O2S/c1-20-24(27(33)31-28(29-20)34-19-22-12-6-3-7-13-22)16-17-26(32)30-25-15-9-8-14-23(25)18-21-10-4-2-5-11-21/h2-15H,16-19H2,1H3,(H,30,32)(H,29,31,33)