3-(4-bromanylthiophen-2-yl)-2-(2,4-dichlorophenyl)-4,4-dimethyl-N-piperidin-1-yl-3H-pyrazole-5-carboxamide

Systemtic Name: 3-(4-bromanylthiophen-2-yl)-2-(2,4-dichlorophenyl)-4,4-dimethyl-N-piperidin-1-yl-3H-pyrazole-5-carboxamide Openeye Name: 3-(4-bromo-2-thienyl)-2-(2,4-dichlorophenyl)-4,4-dimethyl-N-(1-piperidyl)-3H-pyrazole-5-carboxamide CAS Name: 3-(4-bromo-2-thiophenyl)-2-(2,4-dichlorophenyl)-4,4-dimethyl-N-(1-piperidinyl)-3H-pyrazole-5-carboxamide IUPAC Name: 3-(4-bromothiophen-2-yl)-2-(2,4-dichlorophenyl)-4,4-dimethyl-N-piperidin-1-yl-3H-pyrazole-5-carboxamide Traditional Name: 5-(4-bromo-2-thienyl)-1-(2,4-dichlorophenyl)-4,4-dimethyl-N-piperidino-2-pyrazoline-3-carboxamide Formula: C21H23BrCl2N4OS MolecularWeight: 530.30852

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(N(N=C1C(=O)NN2CCCCC2)C3=C(C=C(C=C3)Cl)Cl)C4=CC(=CS4)Br)C

Isomeric SMILES

CC1(C(N(N=C1C(=O)NN2CCCCC2)C3=C(C=C(C=C3)Cl)Cl)C4=CC(=CS4)Br)C

InChI

InChI=1S/C21H23BrCl2N4OS/c1-21(2)18(20(29)26-27-8-4-3-5-9-27)25-28(16-7-6-14(23)11-15(16)24)19(21)17-10-13(22)12-30-17/h6-7,10-12,19H,3-5,8-9H2,1-2H3,(H,26,29)