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

Systemtic Name: 6-azanyl-2-[(1R)-2-oxidanylidene-1-phenyl-2-pyrrolidin-1-yl-ethyl]sulfanyl-1H-pyrimidin-4-one Openeye Name: 6-amino-2-[(1R)-2-oxo-1-phenyl-2-pyrrolidin-1-yl-ethyl]sulfanyl-1H-pyrimidin-4-one CAS Name: 6-amino-2-[[(1R)-2-oxo-1-phenyl-2-(1-pyrrolidinyl)ethyl]thio]-1H-pyrimidin-4-one IUPAC Name: 6-amino-2-[(1R)-2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl]sulfanyl-1H-pyrimidin-4-one Traditional Name: 6-amino-2-[[(1R)-2-keto-1-phenyl-2-pyrrolidino-ethyl]thio]-1H-pyrimidin-4-one Formula: C16H18N4O2S MolecularWeight: 330.40472

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C(C2=CC=CC=C2)SC3=NC(=O)C=C(N3)N

Isomeric SMILES

C1CCN(C1)C(=O)[C@@H](C2=CC=CC=C2)SC3=NC(=O)C=C(N3)N

InChI

InChI=1S/C16H18N4O2S/c17-12-10-13(21)19-16(18-12)23-14(11-6-2-1-3-7-11)15(22)20-8-4-5-9-20/h1-3,6-7,10,14H,4-5,8-9H2,(H3,17,18,19,21)/t14-/m1/s1