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

Systemtic Name: N-cyclohexyl-N-methyl-3-[6-methyl-4-oxidanylidene-2-(phenylmethylsulfanyl)-1H-pyrimidin-5-yl]propanamide Openeye Name: 3-(2-benzylsulfanyl-6-methyl-4-oxo-1H-pyrimidin-5-yl)-N-cyclohexyl-N-methyl-propanamide CAS Name: N-cyclohexyl-N-methyl-3-[6-methyl-4-oxo-2-(phenylmethylthio)-1H-pyrimidin-5-yl]propanamide IUPAC Name: 3-(2-benzylsulfanyl-6-methyl-4-oxo-1H-pyrimidin-5-yl)-N-cyclohexyl-N-methylpropanamide Traditional Name: 3-[2-(benzylthio)-4-keto-6-methyl-1H-pyrimidin-5-yl]-N-cyclohexyl-N-methyl-propionamide Formula: C22H29N3O2S MolecularWeight: 399.54956

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)SCC2=CC=CC=C2)CCC(=O)N(C)C3CCCCC3

Isomeric SMILES

CC1=C(C(=O)N=C(N1)SCC2=CC=CC=C2)CCC(=O)N(C)C3CCCCC3

InChI

InChI=1S/C22H29N3O2S/c1-16-19(13-14-20(26)25(2)18-11-7-4-8-12-18)21(27)24-22(23-16)28-15-17-9-5-3-6-10-17/h3,5-6,9-10,18H,4,7-8,11-15H2,1-2H3,(H,23,24,27)