(2S)-2-(2-methyl-6-phenyl-pyrimidin-4-yl)sulfanyl-1-pyrrolidin-1-yl-propan-1-one

Systemtic Name: (2S)-2-(2-methyl-6-phenyl-pyrimidin-4-yl)sulfanyl-1-pyrrolidin-1-yl-propan-1-one Openeye Name: (2S)-2-(2-methyl-6-phenyl-pyrimidin-4-yl)sulfanyl-1-pyrrolidin-1-yl-propan-1-one CAS Name: (2S)-2-[(2-methyl-6-phenyl-4-pyrimidinyl)thio]-1-(1-pyrrolidinyl)-1-propanone IUPAC Name: (2S)-2-(2-methyl-6-phenylpyrimidin-4-yl)sulfanyl-1-pyrrolidin-1-ylpropan-1-one Traditional Name: (2S)-2-[(2-methyl-6-phenyl-pyrimidin-4-yl)thio]-1-pyrrolidino-propan-1-one Formula: C18H21N3OS MolecularWeight: 327.44384

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC(=N1)SC(C)C(=O)N2CCCC2)C3=CC=CC=C3

Isomeric SMILES

CC1=NC(=CC(=N1)S[C@@H](C)C(=O)N2CCCC2)C3=CC=CC=C3

InChI

InChI=1S/C18H21N3OS/c1-13(18(22)21-10-6-7-11-21)23-17-12-16(19-14(2)20-17)15-8-4-3-5-9-15/h3-5,8-9,12-13H,6-7,10-11H2,1-2H3/t13-/m0/s1