N-(cyclohexylmethyl)-2-[6-methyl-4-oxidanylidene-2-(phenylmethylsulfanyl)-1H-pyrimidin-5-yl]ethanamide

Systemtic Name: N-(cyclohexylmethyl)-2-[6-methyl-4-oxidanylidene-2-(phenylmethylsulfanyl)-1H-pyrimidin-5-yl]ethanamide Openeye Name: 2-(2-benzylsulfanyl-6-methyl-4-oxo-1H-pyrimidin-5-yl)-N-(cyclohexylmethyl)acetamide CAS Name: N-(cyclohexylmethyl)-2-[6-methyl-4-oxo-2-(phenylmethylthio)-1H-pyrimidin-5-yl]acetamide IUPAC Name: 2-(2-benzylsulfanyl-6-methyl-4-oxo-1H-pyrimidin-5-yl)-N-(cyclohexylmethyl)acetamide Traditional Name: 2-[2-(benzylthio)-4-keto-6-methyl-1H-pyrimidin-5-yl]-N-(cyclohexylmethyl)acetamide Formula: C21H27N3O2S MolecularWeight: 385.52298

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)SCC2=CC=CC=C2)CC(=O)NCC3CCCCC3

Isomeric SMILES

CC1=C(C(=O)N=C(N1)SCC2=CC=CC=C2)CC(=O)NCC3CCCCC3

InChI

InChI=1S/C21H27N3O2S/c1-15-18(12-19(25)22-13-16-8-4-2-5-9-16)20(26)24-21(23-15)27-14-17-10-6-3-7-11-17/h3,6-7,10-11,16H,2,4-5,8-9,12-14H2,1H3,(H,22,25)(H,23,24,26)