3-(4,6-diphenylpyrimidin-2-yl)sulfanyl-1-pyrrolidin-1-yl-propan-1-one

Systemtic Name: 3-(4,6-diphenylpyrimidin-2-yl)sulfanyl-1-pyrrolidin-1-yl-propan-1-one Openeye Name: 3-(4,6-diphenylpyrimidin-2-yl)sulfanyl-1-pyrrolidin-1-yl-propan-1-one CAS Name: 3-[(4,6-diphenyl-2-pyrimidinyl)thio]-1-(1-pyrrolidinyl)-1-propanone IUPAC Name: 3-(4,6-diphenylpyrimidin-2-yl)sulfanyl-1-pyrrolidin-1-ylpropan-1-one Traditional Name: 3-[(4,6-diphenylpyrimidin-2-yl)thio]-1-pyrrolidino-propan-1-one Formula: C23H23N3OS MolecularWeight: 389.51322

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)CCSC2=NC(=CC(=N2)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1CCN(C1)C(=O)CCSC2=NC(=CC(=N2)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C23H23N3OS/c27-22(26-14-7-8-15-26)13-16-28-23-24-20(18-9-3-1-4-10-18)17-21(25-23)19-11-5-2-6-12-19/h1-6,9-12,17H,7-8,13-16H2