5-(5-but-1-ynylthiophen-2-yl)-1-(2,4-dichlorophenyl)-4-methyl-N-piperidin-1-yl-pyrazole-3-carboxamide

Systemtic Name: 5-(5-but-1-ynylthiophen-2-yl)-1-(2,4-dichlorophenyl)-4-methyl-N-piperidin-1-yl-pyrazole-3-carboxamide Openeye Name: 5-(5-but-1-ynyl-2-thienyl)-1-(2,4-dichlorophenyl)-4-methyl-N-(1-piperidyl)pyrazole-3-carboxamide CAS Name: 5-(5-but-1-ynyl-2-thiophenyl)-1-(2,4-dichlorophenyl)-4-methyl-N-(1-piperidinyl)-3-pyrazolecarboxamide IUPAC Name: 5-(5-but-1-ynylthiophen-2-yl)-1-(2,4-dichlorophenyl)-4-methyl-N-piperidin-1-ylpyrazole-3-carboxamide Traditional Name: 5-(5-but-1-ynyl-2-thienyl)-1-(2,4-dichlorophenyl)-4-methyl-N-piperidino-pyrazole-3-carboxamide Formula: C24H24Cl2N4OS MolecularWeight: 487.44456

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Descriptors Computed from Structure

Canonical SMILES:

CCC#CC1=CC=C(S1)C2=C(C(=NN2C3=C(C=C(C=C3)Cl)Cl)C(=O)NN4CCCCC4)C

Isomeric SMILES

CCC#CC1=CC=C(S1)C2=C(C(=NN2C3=C(C=C(C=C3)Cl)Cl)C(=O)NN4CCCCC4)C

InChI

InChI=1S/C24H24Cl2N4OS/c1-3-4-8-18-10-12-21(32-18)23-16(2)22(24(31)28-29-13-6-5-7-14-29)27-30(23)20-11-9-17(25)15-19(20)26/h9-12,15H,3,5-7,13-14H2,1-2H3,(H,28,31)