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

Systemtic Name: N-(cyclopropylmethyl)-4-(2,3-dimethoxyphenyl)-1-(ethylcarbamothioyl)pyrrolidine-3-carboxamide Openeye Name: N-(cyclopropylmethyl)-4-(2,3-dimethoxyphenyl)-1-(ethylcarbamothioyl)pyrrolidine-3-carboxamide CAS Name: N-(cyclopropylmethyl)-4-(2,3-dimethoxyphenyl)-1-[ethylamino(sulfanylidene)methyl]-3-pyrrolidinecarboxamide IUPAC Name: N-(cyclopropylmethyl)-4-(2,3-dimethoxyphenyl)-1-(ethylcarbamothioyl)pyrrolidine-3-carboxamide Traditional Name: N-(cyclopropylmethyl)-4-(2,3-dimethoxyphenyl)-1-(ethylthiocarbamoyl)pyrrolidine-3-carboxamide Formula: C20H29N3O3S MolecularWeight: 391.52756

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)N1CC(C(C1)C(=O)NCC2CC2)C3=C(C(=CC=C3)OC)OC

Isomeric SMILES

CCNC(=S)N1CC(C(C1)C(=O)NCC2CC2)C3=C(C(=CC=C3)OC)OC

InChI

InChI=1S/C20H29N3O3S/c1-4-21-20(27)23-11-15(14-6-5-7-17(25-2)18(14)26-3)16(12-23)19(24)22-10-13-8-9-13/h5-7,13,15-16H,4,8-12H2,1-3H3,(H,21,27)(H,22,24)