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

Systemtic Name: 1-(ethylcarbamothioyl)-4-(3-fluorophenyl)-N-(3-methylbutyl)pyrrolidine-3-carboxamide Openeye Name: 1-(ethylcarbamothioyl)-4-(3-fluorophenyl)-N-isopentyl-pyrrolidine-3-carboxamide CAS Name: 1-[ethylamino(sulfanylidene)methyl]-4-(3-fluorophenyl)-N-(3-methylbutyl)-3-pyrrolidinecarboxamide IUPAC Name: 1-(ethylcarbamothioyl)-4-(3-fluorophenyl)-N-(3-methylbutyl)pyrrolidine-3-carboxamide Traditional Name: 1-(ethylthiocarbamoyl)-4-(3-fluorophenyl)-N-isoamyl-pyrrolidine-3-carboxamide Formula: C19H28FN3OS MolecularWeight: 365.508523

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H28FN3OS/c1-4-21-19(25)23-11-16(14-6-5-7-15(20)10-14)17(12-23)18(24)22-9-8-13(2)3/h5-7,10,13,16-17H,4,8-9,11-12H2,1-3H3,(H,21,25)(H,22,24)