3-chloranyl-N-[1-[(4-chlorophenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]-4-fluoranyl-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-[1-[(4-chlorophenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]-4-fluoranyl-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-[1-[(4-chlorophenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]-4-fluoro-benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[1-[(4-chlorophenyl)methyl]-3,5-dimethyl-4-pyrazolyl]-4-fluoro-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-[1-[(4-chlorophenyl)methyl]-3,5-dimethylpyrazol-4-yl]-4-fluoro-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-[1-(4-chlorobenzyl)-3,5-dimethyl-pyrazol-4-yl]-4-fluoro-benzothiophene-2-carboxamide Formula: C21H16Cl2FN3OS MolecularWeight: 448.340643

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=C(C=C2)Cl)C)NC(=O)C3=C(C4=C(C=CC=C4S3)F)Cl

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=C(C=C2)Cl)C)NC(=O)C3=C(C4=C(C=CC=C4S3)F)Cl

InChI

InChI=1S/C21H16Cl2FN3OS/c1-11-19(12(2)27(26-11)10-13-6-8-14(22)9-7-13)25-21(28)20-18(23)17-15(24)4-3-5-16(17)29-20/h3-9H,10H2,1-2H3,(H,25,28)