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

Systemtic Name: N'-butyl-5-(5-chloranylthiophen-2-yl)-N-cyano-4-(2-oxidanylidenepyrrolidin-1-yl)-3,4-dihydropyrazole-2-carboximidamide Openeye Name: N'-butyl-5-(5-chloro-2-thienyl)-N-cyano-4-(2-oxopyrrolidin-1-yl)-3,4-dihydropyrazole-2-carboxamidine CAS Name: N'-butyl-5-(5-chloro-2-thiophenyl)-N-cyano-4-(2-oxo-1-pyrrolidinyl)-3,4-dihydropyrazole-2-carboximidamide IUPAC Name: N'-butyl-5-(5-chlorothiophen-2-yl)-N-cyano-4-(2-oxopyrrolidin-1-yl)-3,4-dihydropyrazole-2-carboximidamide Traditional Name: N'-butyl-3-(5-chloro-2-thienyl)-N-cyano-4-(2-ketopyrrolidino)-2-pyrazoline-1-carboxamidine Formula: C17H21ClN6OS MolecularWeight: 392.90624

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN=C(NC#N)N1CC(C(=N1)C2=CC=C(S2)Cl)N3CCCC3=O

Isomeric SMILES

CCCCN=C(NC#N)N1CC(C(=N1)C2=CC=C(S2)Cl)N3CCCC3=O

InChI

InChI=1S/C17H21ClN6OS/c1-2-3-8-20-17(21-11-19)24-10-12(23-9-4-5-15(23)25)16(22-24)13-6-7-14(18)26-13/h6-7,12H,2-5,8-10H2,1H3,(H,20,21)