N-[2-[(4-bromanylthiophen-2-yl)methyl]pyrazol-3-yl]-3-chloranyl-1-benzothiophene-2-carboxamide

Systemtic Name: N-[2-[(4-bromanylthiophen-2-yl)methyl]pyrazol-3-yl]-3-chloranyl-1-benzothiophene-2-carboxamide Openeye Name: N-[2-[(4-bromo-2-thienyl)methyl]pyrazol-3-yl]-3-chloro-benzothiophene-2-carboxamide CAS Name: N-[2-[(4-bromo-2-thiophenyl)methyl]-3-pyrazolyl]-3-chloro-1-benzothiophene-2-carboxamide IUPAC Name: N-[2-[(4-bromothiophen-2-yl)methyl]pyrazol-3-yl]-3-chloro-1-benzothiophene-2-carboxamide Traditional Name: N-[2-[(4-bromo-2-thienyl)methyl]pyrazol-3-yl]-3-chloro-benzothiophene-2-carboxamide Formula: C17H11BrClN3OS2 MolecularWeight: 452.77574

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(S2)C(=O)NC3=CC=NN3CC4=CC(=CS4)Br)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=C(S2)C(=O)NC3=CC=NN3CC4=CC(=CS4)Br)Cl

InChI

InChI=1S/C17H11BrClN3OS2/c18-10-7-11(24-9-10)8-22-14(5-6-20-22)21-17(23)16-15(19)12-3-1-2-4-13(12)25-16/h1-7,9H,8H2,(H,21,23)