2-[(1S)-2-oxidanylidene-1-phenyl-2-pyrrolidin-1-yl-ethyl]sulfanyl-6-propyl-1H-pyrimidin-4-one

Systemtic Name: 2-[(1S)-2-oxidanylidene-1-phenyl-2-pyrrolidin-1-yl-ethyl]sulfanyl-6-propyl-1H-pyrimidin-4-one Openeye Name: 2-[(1S)-2-oxo-1-phenyl-2-pyrrolidin-1-yl-ethyl]sulfanyl-6-propyl-1H-pyrimidin-4-one CAS Name: 2-[[(1S)-2-oxo-1-phenyl-2-(1-pyrrolidinyl)ethyl]thio]-6-propyl-1H-pyrimidin-4-one IUPAC Name: 2-[(1S)-2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl]sulfanyl-6-propyl-1H-pyrimidin-4-one Traditional Name: 2-[[(1S)-2-keto-1-phenyl-2-pyrrolidino-ethyl]thio]-6-propyl-1H-pyrimidin-4-one Formula: C19H23N3O2S MolecularWeight: 357.46982

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)N=C(N1)SC(C2=CC=CC=C2)C(=O)N3CCCC3

Isomeric SMILES

CCCC1=CC(=O)N=C(N1)S[C@@H](C2=CC=CC=C2)C(=O)N3CCCC3

InChI

InChI=1S/C19H23N3O2S/c1-2-8-15-13-16(23)21-19(20-15)25-17(14-9-4-3-5-10-14)18(24)22-11-6-7-12-22/h3-5,9-10,13,17H,2,6-8,11-12H2,1H3,(H,20,21,23)/t17-/m0/s1