(3S,4R)-N-isoquinolin-6-yl-4-thiophen-3-yl-pyrrolidine-3-carboxamide

Systemtic Name: (3S,4R)-N-isoquinolin-6-yl-4-thiophen-3-yl-pyrrolidine-3-carboxamide Openeye Name: (3S,4R)-N-(6-isoquinolyl)-4-(3-thienyl)pyrrolidine-3-carboxamide CAS Name: (3S,4R)-N-(6-isoquinolinyl)-4-(3-thiophenyl)-3-pyrrolidinecarboxamide IUPAC Name: (3S,4R)-N-isoquinolin-6-yl-4-thiophen-3-ylpyrrolidine-3-carboxamide Traditional Name: (3S,4R)-N-(6-isoquinolyl)-4-(3-thienyl)pyrrolidine-3-carboxamide Formula: C18H17N3OS MolecularWeight: 323.41208

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(C(CN1)C(=O)NC2=CC3=C(C=C2)C=NC=C3)C4=CSC=C4

Isomeric SMILES

C1[C@H]([C@@H](CN1)C(=O)NC2=CC3=C(C=C2)C=NC=C3)C4=CSC=C4

InChI

InChI=1S/C18H17N3OS/c22-18(17-10-20-9-16(17)14-4-6-23-11-14)21-15-2-1-13-8-19-5-3-12(13)7-15/h1-8,11,16-17,20H,9-10H2,(H,21,22)/t16-,17+/m0/s1