N-(azepan-1-yl)-1-(2,4-dichlorophenyl)-4-methyl-5-(5-methylthiophen-2-yl)pyrazole-3-carboxamide

Systemtic Name: N-(azepan-1-yl)-1-(2,4-dichlorophenyl)-4-methyl-5-(5-methylthiophen-2-yl)pyrazole-3-carboxamide Openeye Name: N-(azepan-1-yl)-1-(2,4-dichlorophenyl)-4-methyl-5-(5-methyl-2-thienyl)pyrazole-3-carboxamide CAS Name: N-(1-azepanyl)-1-(2,4-dichlorophenyl)-4-methyl-5-(5-methyl-2-thiophenyl)-3-pyrazolecarboxamide IUPAC Name: N-(azepan-1-yl)-1-(2,4-dichlorophenyl)-4-methyl-5-(5-methylthiophen-2-yl)pyrazole-3-carboxamide Traditional Name: N-(azepan-1-yl)-1-(2,4-dichlorophenyl)-4-methyl-5-(5-methyl-2-thienyl)pyrazole-3-carboxamide Formula: C22H24Cl2N4OS MolecularWeight: 463.42316

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C2=C(C(=NN2C3=C(C=C(C=C3)Cl)Cl)C(=O)NN4CCCCCC4)C

Isomeric SMILES

CC1=CC=C(S1)C2=C(C(=NN2C3=C(C=C(C=C3)Cl)Cl)C(=O)NN4CCCCCC4)C

InChI

InChI=1S/C22H24Cl2N4OS/c1-14-7-10-19(30-14)21-15(2)20(22(29)26-27-11-5-3-4-6-12-27)25-28(21)18-9-8-16(23)13-17(18)24/h7-10,13H,3-6,11-12H2,1-2H3,(H,26,29)