1-[4-[3-(cyclopropylmethoxy)-4-methoxy-phenyl]-3-(1-hydroxyethyl)-3-methyl-pyrrolidin-1-yl]-2-sulfanyl-ethanone

Systemtic Name: 1-[4-[3-(cyclopropylmethoxy)-4-methoxy-phenyl]-3-(1-hydroxyethyl)-3-methyl-pyrrolidin-1-yl]-2-sulfanyl-ethanone Openeye Name: 1-[4-[3-(cyclopropylmethoxy)-4-methoxy-phenyl]-3-(1-hydroxyethyl)-3-methyl-pyrrolidin-1-yl]-2-sulfanyl-ethanone CAS Name: 1-[4-[3-(cyclopropylmethoxy)-4-methoxyphenyl]-3-(1-hydroxyethyl)-3-methyl-1-pyrrolidinyl]-2-mercaptoethanone IUPAC Name: 1-[4-[3-(cyclopropylmethoxy)-4-methoxyphenyl]-3-(1-hydroxyethyl)-3-methylpyrrolidin-1-yl]-2-sulfanylethanone Traditional Name: 1-[4-[3-(cyclopropylmethoxy)-4-methoxy-phenyl]-3-(1-hydroxyethyl)-3-methyl-pyrrolidino]-2-mercapto-ethanone Formula: C20H29NO4S MolecularWeight: 379.51356

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1(CN(CC1C2=CC(=C(C=C2)OC)OCC3CC3)C(=O)CS)C)O

Isomeric SMILES

CC(C1(CN(CC1C2=CC(=C(C=C2)OC)OCC3CC3)C(=O)CS)C)O

InChI

InChI=1S/C20H29NO4S/c1-13(22)20(2)12-21(19(23)11-26)9-16(20)15-6-7-17(24-3)18(8-15)25-10-14-4-5-14/h6-8,13-14,16,22,26H,4-5,9-12H2,1-3H3