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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC(=C1)C2=CC=CC=C2)SCC(=O)N3CCCC3

Isomeric SMILES

CC1=NC(=NC(=C1)C2=CC=CC=C2)SCC(=O)N3CCCC3

InChI

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