(3R)-N-[2-[(4-bromanylthiophen-2-yl)methyl]pyrazol-3-yl]-1-oxidanylidene-3,4-dihydroisochromene-3-carboxamide

Systemtic Name: (3R)-N-[2-[(4-bromanylthiophen-2-yl)methyl]pyrazol-3-yl]-1-oxidanylidene-3,4-dihydroisochromene-3-carboxamide Openeye Name: (3R)-N-[2-[(4-bromo-2-thienyl)methyl]pyrazol-3-yl]-1-oxo-isochromane-3-carboxamide CAS Name: (3R)-N-[2-[(4-bromo-2-thiophenyl)methyl]-3-pyrazolyl]-1-oxo-3,4-dihydro-1H-2-benzopyran-3-carboxamide IUPAC Name: (3R)-N-[2-[(4-bromothiophen-2-yl)methyl]pyrazol-3-yl]-1-oxo-3,4-dihydroisochromene-3-carboxamide Traditional Name: (3R)-N-[2-[(4-bromo-2-thienyl)methyl]pyrazol-3-yl]-1-keto-isochroman-3-carboxamide Formula: C18H14BrN3O3S MolecularWeight: 432.29106

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC(=O)C2=CC=CC=C21)C(=O)NC3=CC=NN3CC4=CC(=CS4)Br

Isomeric SMILES

C1[C@@H](OC(=O)C2=CC=CC=C21)C(=O)NC3=CC=NN3CC4=CC(=CS4)Br

InChI

InChI=1S/C18H14BrN3O3S/c19-12-8-13(26-10-12)9-22-16(5-6-20-22)21-17(23)15-7-11-3-1-2-4-14(11)18(24)25-15/h1-6,8,10,15H,7,9H2,(H,21,23)/t15-/m1/s1