6-methyl-2-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)sulfanyl-5-(phenylmethyl)-1H-pyrimidin-4-one

Systemtic Name: 6-methyl-2-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)sulfanyl-5-(phenylmethyl)-1H-pyrimidin-4-one Openeye Name: 5-benzyl-6-methyl-2-(2-oxo-2-pyrrolidin-1-yl-ethyl)sulfanyl-1H-pyrimidin-4-one CAS Name: 6-methyl-2-[[2-oxo-2-(1-pyrrolidinyl)ethyl]thio]-5-(phenylmethyl)-1H-pyrimidin-4-one IUPAC Name: 5-benzyl-6-methyl-2-(2-oxo-2-pyrrolidin-1-ylethyl)sulfanyl-1H-pyrimidin-4-one Traditional Name: 5-benzyl-2-[(2-keto-2-pyrrolidino-ethyl)thio]-6-methyl-1H-pyrimidin-4-one Formula: C18H21N3O2S MolecularWeight: 343.44324

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)SCC(=O)N2CCCC2)CC3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=O)N=C(N1)SCC(=O)N2CCCC2)CC3=CC=CC=C3

InChI

InChI=1S/C18H21N3O2S/c1-13-15(11-14-7-3-2-4-8-14)17(23)20-18(19-13)24-12-16(22)21-9-5-6-10-21/h2-4,7-8H,5-6,9-12H2,1H3,(H,19,20,23)