(2S,4R)-N-cyclopropyl-1-(1-ethylpiperidin-4-yl)-4-(4-fluorophenyl)sulfanyl-pyrrolidine-2-carboxamide

Systemtic Name: (2S,4R)-N-cyclopropyl-1-(1-ethylpiperidin-4-yl)-4-(4-fluorophenyl)sulfanyl-pyrrolidine-2-carboxamide Openeye Name: (2S,4R)-N-cyclopropyl-1-(1-ethyl-4-piperidyl)-4-(4-fluorophenyl)sulfanyl-pyrrolidine-2-carboxamide CAS Name: (2S,4R)-N-cyclopropyl-1-(1-ethyl-4-piperidinyl)-4-[(4-fluorophenyl)thio]-2-pyrrolidinecarboxamide IUPAC Name: (2S,4R)-N-cyclopropyl-1-(1-ethylpiperidin-4-yl)-4-(4-fluorophenyl)sulfanylpyrrolidine-2-carboxamide Traditional Name: (2S,4R)-N-cyclopropyl-1-(1-ethyl-4-piperidyl)-4-[(4-fluorophenyl)thio]pyrrolidine-2-carboxamide Formula: C21H30FN3OS MolecularWeight: 391.545803

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1CCC(CC1)N2CC(CC2C(=O)NC3CC3)SC4=CC=C(C=C4)F

Isomeric SMILES

CCN1CCC(CC1)N2C[C@@H](C[C@H]2C(=O)NC3CC3)SC4=CC=C(C=C4)F

InChI

InChI=1S/C21H30FN3OS/c1-2-24-11-9-17(10-12-24)25-14-19(27-18-7-3-15(22)4-8-18)13-20(25)21(26)23-16-5-6-16/h3-4,7-8,16-17,19-20H,2,5-6,9-14H2,1H3,(H,23,26)/t19-,20+/m1/s1