6-methyl-5-(phenylmethyl)-2-(2-piperidin-1-ylethylsulfanyl)-1H-pyrimidin-4-one

Systemtic Name: 6-methyl-5-(phenylmethyl)-2-(2-piperidin-1-ylethylsulfanyl)-1H-pyrimidin-4-one Openeye Name: 5-benzyl-6-methyl-2-[2-(1-piperidyl)ethylsulfanyl]-1H-pyrimidin-4-one CAS Name: 6-methyl-5-(phenylmethyl)-2-[2-(1-piperidinyl)ethylthio]-1H-pyrimidin-4-one IUPAC Name: 5-benzyl-6-methyl-2-(2-piperidin-1-ylethylsulfanyl)-1H-pyrimidin-4-one Traditional Name: 5-benzyl-6-methyl-2-(2-piperidinoethylthio)-1H-pyrimidin-4-one Formula: C19H25N3OS MolecularWeight: 343.4863

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)SCCN2CCCCC2)CC3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=O)N=C(N1)SCCN2CCCCC2)CC3=CC=CC=C3

InChI

InChI=1S/C19H25N3OS/c1-15-17(14-16-8-4-2-5-9-16)18(23)21-19(20-15)24-13-12-22-10-6-3-7-11-22/h2,4-5,8-9H,3,6-7,10-14H2,1H3,(H,20,21,23)