N-[(2,4-dimethoxyphenyl)methyl]-1-(5-pyrrolidin-1-yl-1,3,4-thiadiazol-2-yl)pyrrole-2-carboxamide

Systemtic Name: N-[(2,4-dimethoxyphenyl)methyl]-1-(5-pyrrolidin-1-yl-1,3,4-thiadiazol-2-yl)pyrrole-2-carboxamide Openeye Name: N-[(2,4-dimethoxyphenyl)methyl]-1-(5-pyrrolidin-1-yl-1,3,4-thiadiazol-2-yl)pyrrole-2-carboxamide CAS Name: N-[(2,4-dimethoxyphenyl)methyl]-1-[5-(1-pyrrolidinyl)-1,3,4-thiadiazol-2-yl]-2-pyrrolecarboxamide IUPAC Name: N-[(2,4-dimethoxyphenyl)methyl]-1-(5-pyrrolidin-1-yl-1,3,4-thiadiazol-2-yl)pyrrole-2-carboxamide Traditional Name: N-(2,4-dimethoxybenzyl)-1-(5-pyrrolidino-1,3,4-thiadiazol-2-yl)pyrrole-2-carboxamide Formula: C20H23N5O3S MolecularWeight: 413.49332

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)CNC(=O)C2=CC=CN2C3=NN=C(S3)N4CCCC4)OC

Isomeric SMILES

COC1=CC(=C(C=C1)CNC(=O)C2=CC=CN2C3=NN=C(S3)N4CCCC4)OC

InChI

InChI=1S/C20H23N5O3S/c1-27-15-8-7-14(17(12-15)28-2)13-21-18(26)16-6-5-11-25(16)20-23-22-19(29-20)24-9-3-4-10-24/h5-8,11-12H,3-4,9-10,13H2,1-2H3,(H,21,26)