N-[2-[(4-bromanylthiophen-2-yl)methyl]pyrazol-3-yl]-2,3-dihydro-1-benzofuran-2-carboxamide

Systemtic Name: N-[2-[(4-bromanylthiophen-2-yl)methyl]pyrazol-3-yl]-2,3-dihydro-1-benzofuran-2-carboxamide Openeye Name: N-[2-[(4-bromo-2-thienyl)methyl]pyrazol-3-yl]-2,3-dihydrobenzofuran-2-carboxamide CAS Name: N-[2-[(4-bromo-2-thiophenyl)methyl]-3-pyrazolyl]-2,3-dihydrobenzofuran-2-carboxamide IUPAC Name: N-[2-[(4-bromothiophen-2-yl)methyl]pyrazol-3-yl]-2,3-dihydro-1-benzofuran-2-carboxamide Traditional Name: N-[2-[(4-bromo-2-thienyl)methyl]pyrazol-3-yl]coumaran-2-carboxamide Formula: C17H14BrN3O2S MolecularWeight: 404.28096

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=CC=CC=C21)C(=O)NC3=CC=NN3CC4=CC(=CS4)Br

Isomeric SMILES

C1C(OC2=CC=CC=C21)C(=O)NC3=CC=NN3CC4=CC(=CS4)Br

InChI

InChI=1S/C17H14BrN3O2S/c18-12-8-13(24-10-12)9-21-16(5-6-19-21)20-17(22)15-7-11-3-1-2-4-14(11)23-15/h1-6,8,10,15H,7,9H2,(H,20,22)