(2S,4R)-4-(4-fluorophenyl)sulfanyl-1-[(3-hydroxyphenyl)methyl]-N-propan-2-yl-pyrrolidine-2-carboxamide

Systemtic Name: (2S,4R)-4-(4-fluorophenyl)sulfanyl-1-[(3-hydroxyphenyl)methyl]-N-propan-2-yl-pyrrolidine-2-carboxamide Openeye Name: (2S,4R)-4-(4-fluorophenyl)sulfanyl-1-[(3-hydroxyphenyl)methyl]-N-isopropyl-pyrrolidine-2-carboxamide CAS Name: (2S,4R)-4-[(4-fluorophenyl)thio]-1-[(3-hydroxyphenyl)methyl]-N-propan-2-yl-2-pyrrolidinecarboxamide IUPAC Name: (2S,4R)-4-(4-fluorophenyl)sulfanyl-1-[(3-hydroxyphenyl)methyl]-N-propan-2-ylpyrrolidine-2-carboxamide Traditional Name: (2S,4R)-4-[(4-fluorophenyl)thio]-1-(3-hydroxybenzyl)-N-isopropyl-pyrrolidine-2-carboxamide Formula: C21H25FN2O2S MolecularWeight: 388.498803

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C1CC(CN1CC2=CC(=CC=C2)O)SC3=CC=C(C=C3)F

Isomeric SMILES

CC(C)NC(=O)[C@@H]1C[C@H](CN1CC2=CC(=CC=C2)O)SC3=CC=C(C=C3)F

InChI

InChI=1S/C21H25FN2O2S/c1-14(2)23-21(26)20-11-19(27-18-8-6-16(22)7-9-18)13-24(20)12-15-4-3-5-17(25)10-15/h3-10,14,19-20,25H,11-13H2,1-2H3,(H,23,26)/t19-,20+/m1/s1