1-(2,5-dimethoxyphenyl)-5-oxidanylidene-N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]pyrrolidine-3-carboxamide

Systemtic Name: 1-(2,5-dimethoxyphenyl)-5-oxidanylidene-N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]pyrrolidine-3-carboxamide Openeye Name: 1-(2,5-dimethoxyphenyl)-5-oxo-N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]pyrrolidine-3-carboxamide CAS Name: 1-(2,5-dimethoxyphenyl)-5-oxo-N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]-3-pyrrolidinecarboxamide IUPAC Name: 1-(2,5-dimethoxyphenyl)-5-oxo-N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]pyrrolidine-3-carboxamide Traditional Name: 1-(2,5-dimethoxyphenyl)-5-keto-N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]pyrrolidine-3-carboxamide Formula: C22H23N5O4 MolecularWeight: 421.44912

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)N2CC(CC2=O)C(=O)NC3=CC=C(C=C3)CN4C=NC=N4

Isomeric SMILES

COC1=CC(=C(C=C1)OC)N2CC(CC2=O)C(=O)NC3=CC=C(C=C3)CN4C=NC=N4

InChI

InChI=1S/C22H23N5O4/c1-30-18-7-8-20(31-2)19(10-18)27-12-16(9-21(27)28)22(29)25-17-5-3-15(4-6-17)11-26-14-23-13-24-26/h3-8,10,13-14,16H,9,11-12H2,1-2H3,(H,25,29)