5-(5-chloranylthiophen-2-yl)-N-cyano-4-(2-oxidanylidenepyrrolidin-1-yl)-N'-(2-pyridin-3-ylethyl)-3,4-dihydropyrazole-2-carboximidamide

Systemtic Name: 5-(5-chloranylthiophen-2-yl)-N-cyano-4-(2-oxidanylidenepyrrolidin-1-yl)-N'-(2-pyridin-3-ylethyl)-3,4-dihydropyrazole-2-carboximidamide Openeye Name: 5-(5-chloro-2-thienyl)-N-cyano-4-(2-oxopyrrolidin-1-yl)-N'-[2-(3-pyridyl)ethyl]-3,4-dihydropyrazole-2-carboxamidine CAS Name: 5-(5-chloro-2-thiophenyl)-N-cyano-4-(2-oxo-1-pyrrolidinyl)-N'-[2-(3-pyridinyl)ethyl]-3,4-dihydropyrazole-2-carboximidamide IUPAC Name: 5-(5-chlorothiophen-2-yl)-N-cyano-4-(2-oxopyrrolidin-1-yl)-N'-(2-pyridin-3-ylethyl)-3,4-dihydropyrazole-2-carboximidamide Traditional Name: 3-(5-chloro-2-thienyl)-N-cyano-4-(2-ketopyrrolidino)-N'-[2-(3-pyridyl)ethyl]-2-pyrazoline-1-carboxamidine Formula: C20H20ClN7OS MolecularWeight: 441.9371

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)C2CN(N=C2C3=CC=C(S3)Cl)C(=NCCC4=CN=CC=C4)NC#N

Isomeric SMILES

C1CC(=O)N(C1)C2CN(N=C2C3=CC=C(S3)Cl)C(=NCCC4=CN=CC=C4)NC#N

InChI

InChI=1S/C20H20ClN7OS/c21-17-6-5-16(30-17)19-15(27-10-2-4-18(27)29)12-28(26-19)20(25-13-22)24-9-7-14-3-1-8-23-11-14/h1,3,5-6,8,11,15H,2,4,7,9-10,12H2,(H,24,25)