N-[3-[(6-pyrrolidin-1-ylpyridin-3-yl)methylcarbamoyl]phenyl]thiophene-2-carboxamide

Systemtic Name: N-[3-[(6-pyrrolidin-1-ylpyridin-3-yl)methylcarbamoyl]phenyl]thiophene-2-carboxamide Openeye Name: N-[3-[(6-pyrrolidin-1-yl-3-pyridyl)methylcarbamoyl]phenyl]thiophene-2-carboxamide CAS Name: N-[3-[oxo-[[6-(1-pyrrolidinyl)-3-pyridinyl]methylamino]methyl]phenyl]-2-thiophenecarboxamide IUPAC Name: N-[3-[(6-pyrrolidin-1-ylpyridin-3-yl)methylcarbamoyl]phenyl]thiophene-2-carboxamide Traditional Name: N-[3-[(6-pyrrolidino-3-pyridyl)methylcarbamoyl]phenyl]thiophene-2-carboxamide Formula: C22H22N4O2S MolecularWeight: 406.50068

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=NC=C(C=C2)CNC(=O)C3=CC(=CC=C3)NC(=O)C4=CC=CS4

Isomeric SMILES

C1CCN(C1)C2=NC=C(C=C2)CNC(=O)C3=CC(=CC=C3)NC(=O)C4=CC=CS4

InChI

InChI=1S/C22H22N4O2S/c27-21(24-15-16-8-9-20(23-14-16)26-10-1-2-11-26)17-5-3-6-18(13-17)25-22(28)19-7-4-12-29-19/h3-9,12-14H,1-2,10-11,15H2,(H,24,27)(H,25,28)