2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-1-[2-(4-ethoxyphenyl)pyrrolidin-1-yl]ethanone

Systemtic Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-1-[2-(4-ethoxyphenyl)pyrrolidin-1-yl]ethanone Openeye Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-1-[2-(4-ethoxyphenyl)pyrrolidin-1-yl]ethanone CAS Name: 2-[(4,6-dimethyl-2-pyrimidinyl)thio]-1-[2-(4-ethoxyphenyl)-1-pyrrolidinyl]ethanone IUPAC Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-1-[2-(4-ethoxyphenyl)pyrrolidin-1-yl]ethanone Traditional Name: 2-[(4,6-dimethylpyrimidin-2-yl)thio]-1-(2-p-phenetylpyrrolidino)ethanone Formula: C20H25N3O2S MolecularWeight: 371.4964

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2CCCN2C(=O)CSC3=NC(=CC(=N3)C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)C2CCCN2C(=O)CSC3=NC(=CC(=N3)C)C

InChI

InChI=1S/C20H25N3O2S/c1-4-25-17-9-7-16(8-10-17)18-6-5-11-23(18)19(24)13-26-20-21-14(2)12-15(3)22-20/h7-10,12,18H,4-6,11,13H2,1-3H3