1-(ethylcarbamothioyl)-4-(3-fluorophenyl)-N-(3-methoxypropyl)pyrrolidine-3-carboxamide

Systemtic Name: 1-(ethylcarbamothioyl)-4-(3-fluorophenyl)-N-(3-methoxypropyl)pyrrolidine-3-carboxamide Openeye Name: 1-(ethylcarbamothioyl)-4-(3-fluorophenyl)-N-(3-methoxypropyl)pyrrolidine-3-carboxamide CAS Name: 1-[ethylamino(sulfanylidene)methyl]-4-(3-fluorophenyl)-N-(3-methoxypropyl)-3-pyrrolidinecarboxamide IUPAC Name: 1-(ethylcarbamothioyl)-4-(3-fluorophenyl)-N-(3-methoxypropyl)pyrrolidine-3-carboxamide Traditional Name: 1-(ethylthiocarbamoyl)-4-(3-fluorophenyl)-N-(3-methoxypropyl)pyrrolidine-3-carboxamide Formula: C18H26FN3O2S MolecularWeight: 367.481343

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)N1CC(C(C1)C(=O)NCCCOC)C2=CC(=CC=C2)F

Isomeric SMILES

CCNC(=S)N1CC(C(C1)C(=O)NCCCOC)C2=CC(=CC=C2)F

InChI

InChI=1S/C18H26FN3O2S/c1-3-20-18(25)22-11-15(13-6-4-7-14(19)10-13)16(12-22)17(23)21-8-5-9-24-2/h4,6-7,10,15-16H,3,5,8-9,11-12H2,1-2H3,(H,20,25)(H,21,23)