4-[(5-chloranyl-1-benzothiophen-3-yl)methyl]-N-(3-chlorophenyl)-3,5-dimethyl-pyrazole-1-carboxamide

Systemtic Name: 4-[(5-chloranyl-1-benzothiophen-3-yl)methyl]-N-(3-chlorophenyl)-3,5-dimethyl-pyrazole-1-carboxamide Openeye Name: 4-[(5-chlorobenzothiophen-3-yl)methyl]-N-(3-chlorophenyl)-3,5-dimethyl-pyrazole-1-carboxamide CAS Name: 4-[(5-chloro-1-benzothiophen-3-yl)methyl]-N-(3-chlorophenyl)-3,5-dimethyl-1-pyrazolecarboxamide IUPAC Name: 4-[(5-chloro-1-benzothiophen-3-yl)methyl]-N-(3-chlorophenyl)-3,5-dimethylpyrazole-1-carboxamide Traditional Name: 4-[(5-chlorobenzothiophen-3-yl)methyl]-N-(3-chlorophenyl)-3,5-dimethyl-pyrazole-1-carboxamide Formula: C21H17Cl2N3OS MolecularWeight: 430.35018

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C(=O)NC2=CC(=CC=C2)Cl)C)CC3=CSC4=C3C=C(C=C4)Cl

Isomeric SMILES

CC1=C(C(=NN1C(=O)NC2=CC(=CC=C2)Cl)C)CC3=CSC4=C3C=C(C=C4)Cl

InChI

InChI=1S/C21H17Cl2N3OS/c1-12-18(8-14-11-28-20-7-6-16(23)10-19(14)20)13(2)26(25-12)21(27)24-17-5-3-4-15(22)9-17/h3-7,9-11H,8H2,1-2H3,(H,24,27)