2-(4-methyl-6-pyrrolidin-1-yl-pyrimidin-2-yl)sulfanyl-1-phenyl-ethanone

Systemtic Name: 2-(4-methyl-6-pyrrolidin-1-yl-pyrimidin-2-yl)sulfanyl-1-phenyl-ethanone Openeye Name: 2-(4-methyl-6-pyrrolidin-1-yl-pyrimidin-2-yl)sulfanyl-1-phenyl-ethanone CAS Name: 2-[[4-methyl-6-(1-pyrrolidinyl)-2-pyrimidinyl]thio]-1-phenylethanone IUPAC Name: 2-(4-methyl-6-pyrrolidin-1-ylpyrimidin-2-yl)sulfanyl-1-phenylethanone Traditional Name: 2-[(4-methyl-6-pyrrolidino-pyrimidin-2-yl)thio]-1-phenyl-ethanone Formula: C17H19N3OS MolecularWeight: 313.41726

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC(=O)C2=CC=CC=C2)N3CCCC3

Isomeric SMILES

CC1=CC(=NC(=N1)SCC(=O)C2=CC=CC=C2)N3CCCC3

InChI

InChI=1S/C17H19N3OS/c1-13-11-16(20-9-5-6-10-20)19-17(18-13)22-12-15(21)14-7-3-2-4-8-14/h2-4,7-8,11H,5-6,9-10,12H2,1H3