N-butyl-4-(2,3-dimethoxyphenyl)-1-(ethylcarbamothioyl)pyrrolidine-3-carboxamide

Systemtic Name: N-butyl-4-(2,3-dimethoxyphenyl)-1-(ethylcarbamothioyl)pyrrolidine-3-carboxamide Openeye Name: N-butyl-4-(2,3-dimethoxyphenyl)-1-(ethylcarbamothioyl)pyrrolidine-3-carboxamide CAS Name: N-butyl-4-(2,3-dimethoxyphenyl)-1-[ethylamino(sulfanylidene)methyl]-3-pyrrolidinecarboxamide IUPAC Name: N-butyl-4-(2,3-dimethoxyphenyl)-1-(ethylcarbamothioyl)pyrrolidine-3-carboxamide Traditional Name: N-butyl-4-(2,3-dimethoxyphenyl)-1-(ethylthiocarbamoyl)pyrrolidine-3-carboxamide Formula: C20H31N3O3S MolecularWeight: 393.54344

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1CN(CC1C2=C(C(=CC=C2)OC)OC)C(=S)NCC

Isomeric SMILES

CCCCNC(=O)C1CN(CC1C2=C(C(=CC=C2)OC)OC)C(=S)NCC

InChI

InChI=1S/C20H31N3O3S/c1-5-7-11-22-19(24)16-13-23(20(27)21-6-2)12-15(16)14-9-8-10-17(25-3)18(14)26-4/h8-10,15-16H,5-7,11-13H2,1-4H3,(H,21,27)(H,22,24)