N-butyl-4-(3-fluorophenyl)-1-(propan-2-ylcarbamothioyl)pyrrolidine-3-carboxamide

Systemtic Name: N-butyl-4-(3-fluorophenyl)-1-(propan-2-ylcarbamothioyl)pyrrolidine-3-carboxamide Openeye Name: N-butyl-4-(3-fluorophenyl)-1-(isopropylcarbamothioyl)pyrrolidine-3-carboxamide CAS Name: N-butyl-4-(3-fluorophenyl)-1-[(propan-2-ylamino)-sulfanylidenemethyl]-3-pyrrolidinecarboxamide IUPAC Name: N-butyl-4-(3-fluorophenyl)-1-(propan-2-ylcarbamothioyl)pyrrolidine-3-carboxamide Traditional Name: N-butyl-4-(3-fluorophenyl)-1-(isopropylthiocarbamoyl)pyrrolidine-3-carboxamide Formula: C19H28FN3OS MolecularWeight: 365.508523

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1CN(CC1C2=CC(=CC=C2)F)C(=S)NC(C)C

Isomeric SMILES

CCCCNC(=O)C1CN(CC1C2=CC(=CC=C2)F)C(=S)NC(C)C

InChI

InChI=1S/C19H28FN3OS/c1-4-5-9-21-18(24)17-12-23(19(25)22-13(2)3)11-16(17)14-7-6-8-15(20)10-14/h6-8,10,13,16-17H,4-5,9,11-12H2,1-3H3,(H,21,24)(H,22,25)