1-(cyclopropylcarbamothioyl)-4-(2,5-dimethoxyphenyl)-N-(2-methoxyethyl)pyrrolidine-3-carboxamide

Systemtic Name: 1-(cyclopropylcarbamothioyl)-4-(2,5-dimethoxyphenyl)-N-(2-methoxyethyl)pyrrolidine-3-carboxamide Openeye Name: 1-(cyclopropylcarbamothioyl)-4-(2,5-dimethoxyphenyl)-N-(2-methoxyethyl)pyrrolidine-3-carboxamide CAS Name: 1-[(cyclopropylamino)-sulfanylidenemethyl]-4-(2,5-dimethoxyphenyl)-N-(2-methoxyethyl)-3-pyrrolidinecarboxamide IUPAC Name: 1-(cyclopropylcarbamothioyl)-4-(2,5-dimethoxyphenyl)-N-(2-methoxyethyl)pyrrolidine-3-carboxamide Traditional Name: 1-(cyclopropylthiocarbamoyl)-4-(2,5-dimethoxyphenyl)-N-(2-methoxyethyl)pyrrolidine-3-carboxamide Formula: C20H29N3O4S MolecularWeight: 407.52696

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC(=O)C1CN(CC1C2=C(C=CC(=C2)OC)OC)C(=S)NC3CC3

Isomeric SMILES

COCCNC(=O)C1CN(CC1C2=C(C=CC(=C2)OC)OC)C(=S)NC3CC3

InChI

InChI=1S/C20H29N3O4S/c1-25-9-8-21-19(24)17-12-23(20(28)22-13-4-5-13)11-16(17)15-10-14(26-2)6-7-18(15)27-3/h6-7,10,13,16-17H,4-5,8-9,11-12H2,1-3H3,(H,21,24)(H,22,28)