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

Systemtic Name: 1-(cyclopropylcarbamothioyl)-N-(cyclopropylmethyl)-4-(2,3-dimethoxyphenyl)pyrrolidine-3-carboxamide Openeye Name: 1-(cyclopropylcarbamothioyl)-N-(cyclopropylmethyl)-4-(2,3-dimethoxyphenyl)pyrrolidine-3-carboxamide CAS Name: 1-[(cyclopropylamino)-sulfanylidenemethyl]-N-(cyclopropylmethyl)-4-(2,3-dimethoxyphenyl)-3-pyrrolidinecarboxamide IUPAC Name: 1-(cyclopropylcarbamothioyl)-N-(cyclopropylmethyl)-4-(2,3-dimethoxyphenyl)pyrrolidine-3-carboxamide Traditional Name: N-(cyclopropylmethyl)-1-(cyclopropylthiocarbamoyl)-4-(2,3-dimethoxyphenyl)pyrrolidine-3-carboxamide Formula: C21H29N3O3S MolecularWeight: 403.53826

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)C2CN(CC2C(=O)NCC3CC3)C(=S)NC4CC4

Isomeric SMILES

COC1=CC=CC(=C1OC)C2CN(CC2C(=O)NCC3CC3)C(=S)NC4CC4

InChI

InChI=1S/C21H29N3O3S/c1-26-18-5-3-4-15(19(18)27-2)16-11-24(21(28)23-14-8-9-14)12-17(16)20(25)22-10-13-6-7-13/h3-5,13-14,16-17H,6-12H2,1-2H3,(H,22,25)(H,23,28)