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

Systemtic Name: 3-[6-methyl-4-oxidanylidene-2-(phenylmethylsulfanyl)-1H-pyrimidin-5-yl]-N-(phenylmethyl)propanamide Openeye Name: N-benzyl-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-(phenylmethyl)propanamide IUPAC Name: N-benzyl-3-(2-benzylsulfanyl-6-methyl-4-oxo-1H-pyrimidin-5-yl)propanamide Traditional Name: N-benzyl-3-[2-(benzylthio)-4-keto-6-methyl-1H-pyrimidin-5-yl]propionamide Formula: C22H23N3O2S MolecularWeight: 393.50192

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)SCC2=CC=CC=C2)CCC(=O)NCC3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=O)N=C(N1)SCC2=CC=CC=C2)CCC(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C22H23N3O2S/c1-16-19(12-13-20(26)23-14-17-8-4-2-5-9-17)21(27)25-22(24-16)28-15-18-10-6-3-7-11-18/h2-11H,12-15H2,1H3,(H,23,26)(H,24,25,27)