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

Systemtic Name: 3-[6-methyl-4-oxidanylidene-2-(phenylmethylsulfanyl)-1H-pyrimidin-5-yl]-N-phenethyl-N-(phenylmethyl)propanamide Openeye Name: N-benzyl-3-(2-benzylsulfanyl-6-methyl-4-oxo-1H-pyrimidin-5-yl)-N-phenethyl-propanamide CAS Name: 3-[6-methyl-4-oxo-2-(phenylmethylthio)-1H-pyrimidin-5-yl]-N-phenethyl-N-(phenylmethyl)propanamide IUPAC Name: N-benzyl-3-(2-benzylsulfanyl-6-methyl-4-oxo-1H-pyrimidin-5-yl)-N-phenethylpropanamide Traditional Name: N-benzyl-3-[2-(benzylthio)-4-keto-6-methyl-1H-pyrimidin-5-yl]-N-phenethyl-propionamide Formula: C30H31N3O2S MolecularWeight: 497.65104

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)SCC2=CC=CC=C2)CCC(=O)N(CCC3=CC=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=O)N=C(N1)SCC2=CC=CC=C2)CCC(=O)N(CCC3=CC=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C30H31N3O2S/c1-23-27(29(35)32-30(31-23)36-22-26-15-9-4-10-16-26)17-18-28(34)33(21-25-13-7-3-8-14-25)20-19-24-11-5-2-6-12-24/h2-16H,17-22H2,1H3,(H,31,32,35)