4-(2,3-dimethoxyphenyl)-1-(propan-2-ylcarbamothioyl)-N-propyl-pyrrolidine-3-carboxamide

Systemtic Name: 4-(2,3-dimethoxyphenyl)-1-(propan-2-ylcarbamothioyl)-N-propyl-pyrrolidine-3-carboxamide Openeye Name: 4-(2,3-dimethoxyphenyl)-1-(isopropylcarbamothioyl)-N-propyl-pyrrolidine-3-carboxamide CAS Name: 4-(2,3-dimethoxyphenyl)-1-[(propan-2-ylamino)-sulfanylidenemethyl]-N-propyl-3-pyrrolidinecarboxamide IUPAC Name: 4-(2,3-dimethoxyphenyl)-1-(propan-2-ylcarbamothioyl)-N-propylpyrrolidine-3-carboxamide Traditional Name: 4-(2,3-dimethoxyphenyl)-1-(isopropylthiocarbamoyl)-N-propyl-pyrrolidine-3-carboxamide Formula: C20H31N3O3S MolecularWeight: 393.54344

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1CN(CC1C2=C(C(=CC=C2)OC)OC)C(=S)NC(C)C

Isomeric SMILES

CCCNC(=O)C1CN(CC1C2=C(C(=CC=C2)OC)OC)C(=S)NC(C)C

InChI

InChI=1S/C20H31N3O3S/c1-6-10-21-19(24)16-12-23(20(27)22-13(2)3)11-15(16)14-8-7-9-17(25-4)18(14)26-5/h7-9,13,15-16H,6,10-12H2,1-5H3,(H,21,24)(H,22,27)