1-[(2S)-2-phenylpyrrolidin-1-yl]carbonyl-4-(pyrimidin-2-ylsulfanylmethyl)azetidin-2-one

Systemtic Name: 1-[(2S)-2-phenylpyrrolidin-1-yl]carbonyl-4-(pyrimidin-2-ylsulfanylmethyl)azetidin-2-one Openeye Name: 1-[(2S)-2-phenylpyrrolidine-1-carbonyl]-4-(pyrimidin-2-ylsulfanylmethyl)azetidin-2-one CAS Name: 1-[oxo-[(2S)-2-phenyl-1-pyrrolidinyl]methyl]-4-[(2-pyrimidinylthio)methyl]-2-azetidinone IUPAC Name: 1-[(2S)-2-phenylpyrrolidine-1-carbonyl]-4-(pyrimidin-2-ylsulfanylmethyl)azetidin-2-one Traditional Name: 1-[(2S)-2-phenylpyrrolidine-1-carbonyl]-4-[(2-pyrimidylthio)methyl]azetidin-2-one Formula: C19H20N4O2S MolecularWeight: 368.4527

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)N2C(CC2=O)CSC3=NC=CC=N3)C4=CC=CC=C4

Isomeric SMILES

C1C[C@H](N(C1)C(=O)N2C(CC2=O)CSC3=NC=CC=N3)C4=CC=CC=C4

InChI

InChI=1S/C19H20N4O2S/c24-17-12-15(13-26-18-20-9-5-10-21-18)23(17)19(25)22-11-4-8-16(22)14-6-2-1-3-7-14/h1-3,5-7,9-10,15-16H,4,8,11-13H2/t15?,16-/m0/s1