(2S,4R)-N-cyclopropyl-4-(4-fluorophenyl)sulfanyl-1-(pyridin-2-ylmethyl)pyrrolidine-2-carboxamide

Systemtic Name: (2S,4R)-N-cyclopropyl-4-(4-fluorophenyl)sulfanyl-1-(pyridin-2-ylmethyl)pyrrolidine-2-carboxamide Openeye Name: (2S,4R)-N-cyclopropyl-4-(4-fluorophenyl)sulfanyl-1-(2-pyridylmethyl)pyrrolidine-2-carboxamide CAS Name: (2S,4R)-N-cyclopropyl-4-[(4-fluorophenyl)thio]-1-(2-pyridinylmethyl)-2-pyrrolidinecarboxamide IUPAC Name: (2S,4R)-N-cyclopropyl-4-(4-fluorophenyl)sulfanyl-1-(pyridin-2-ylmethyl)pyrrolidine-2-carboxamide Traditional Name: (2S,4R)-N-cyclopropyl-4-[(4-fluorophenyl)thio]-1-(2-pyridylmethyl)pyrrolidine-2-carboxamide Formula: C20H22FN3OS MolecularWeight: 371.471583

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C2CC(CN2CC3=CC=CC=N3)SC4=CC=C(C=C4)F

Isomeric SMILES

C1CC1NC(=O)[C@@H]2C[C@H](CN2CC3=CC=CC=N3)SC4=CC=C(C=C4)F

InChI

InChI=1S/C20H22FN3OS/c21-14-4-8-17(9-5-14)26-18-11-19(20(25)23-15-6-7-15)24(13-18)12-16-3-1-2-10-22-16/h1-5,8-10,15,18-19H,6-7,11-13H2,(H,23,25)/t18-,19+/m1/s1