N-[2-[(4-chlorophenyl)methyl]pyrazol-3-yl]-4-fluoranyl-3-(methoxymethyl)-1-benzothiophene-2-carboxamide

Systemtic Name: N-[2-[(4-chlorophenyl)methyl]pyrazol-3-yl]-4-fluoranyl-3-(methoxymethyl)-1-benzothiophene-2-carboxamide Openeye Name: N-[2-[(4-chlorophenyl)methyl]pyrazol-3-yl]-4-fluoro-3-(methoxymethyl)benzothiophene-2-carboxamide CAS Name: N-[2-[(4-chlorophenyl)methyl]-3-pyrazolyl]-4-fluoro-3-(methoxymethyl)-1-benzothiophene-2-carboxamide IUPAC Name: N-[2-[(4-chlorophenyl)methyl]pyrazol-3-yl]-4-fluoro-3-(methoxymethyl)-1-benzothiophene-2-carboxamide Traditional Name: N-[2-(4-chlorobenzyl)pyrazol-3-yl]-4-fluoro-3-(methoxymethyl)benzothiophene-2-carboxamide Formula: C21H17ClFN3O2S MolecularWeight: 429.894983

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Descriptors Computed from Structure

Canonical SMILES:

COCC1=C(SC2=CC=CC(=C21)F)C(=O)NC3=CC=NN3CC4=CC=C(C=C4)Cl

Isomeric SMILES

COCC1=C(SC2=CC=CC(=C21)F)C(=O)NC3=CC=NN3CC4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H17ClFN3O2S/c1-28-12-15-19-16(23)3-2-4-17(19)29-20(15)21(27)25-18-9-10-24-26(18)11-13-5-7-14(22)8-6-13/h2-10H,11-12H2,1H3,(H,25,27)