3-(5-bromanylthiophen-2-yl)-4-cyano-2-(2,4-dichlorophenyl)-N-piperidin-1-yl-3,4-dihydropyrazole-5-carboxamide

Systemtic Name: 3-(5-bromanylthiophen-2-yl)-4-cyano-2-(2,4-dichlorophenyl)-N-piperidin-1-yl-3,4-dihydropyrazole-5-carboxamide Openeye Name: 3-(5-bromo-2-thienyl)-4-cyano-2-(2,4-dichlorophenyl)-N-(1-piperidyl)-3,4-dihydropyrazole-5-carboxamide CAS Name: 3-(5-bromo-2-thiophenyl)-4-cyano-2-(2,4-dichlorophenyl)-N-(1-piperidinyl)-3,4-dihydropyrazole-5-carboxamide IUPAC Name: 3-(5-bromothiophen-2-yl)-4-cyano-2-(2,4-dichlorophenyl)-N-piperidin-1-yl-3,4-dihydropyrazole-5-carboxamide Traditional Name: 5-(5-bromo-2-thienyl)-4-cyano-1-(2,4-dichlorophenyl)-N-piperidino-2-pyrazoline-3-carboxamide Formula: C20H18BrCl2N5OS MolecularWeight: 527.26482

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)NC(=O)C2=NN(C(C2C#N)C3=CC=C(S3)Br)C4=C(C=C(C=C4)Cl)Cl

Isomeric SMILES

C1CCN(CC1)NC(=O)C2=NN(C(C2C#N)C3=CC=C(S3)Br)C4=C(C=C(C=C4)Cl)Cl

InChI

InChI=1S/C20H18BrCl2N5OS/c21-17-7-6-16(30-17)19-13(11-24)18(20(29)26-27-8-2-1-3-9-27)25-28(19)15-5-4-12(22)10-14(15)23/h4-7,10,13,19H,1-3,8-9H2,(H,26,29)