N-[4-(2,3-dihydro-1-benzofuran-5-yl)-1,3-thiazol-2-yl]-5-methylsulfanyl-2-nitro-benzamide

Systemtic Name: N-[4-(2,3-dihydro-1-benzofuran-5-yl)-1,3-thiazol-2-yl]-5-methylsulfanyl-2-nitro-benzamide Openeye Name: N-[4-(2,3-dihydrobenzofuran-5-yl)thiazol-2-yl]-5-methylsulfanyl-2-nitro-benzamide CAS Name: N-[4-(2,3-dihydrobenzofuran-5-yl)-2-thiazolyl]-5-(methylthio)-2-nitrobenzamide IUPAC Name: N-[4-(2,3-dihydro-1-benzofuran-5-yl)-1,3-thiazol-2-yl]-5-methylsulfanyl-2-nitrobenzamide Traditional Name: N-(4-coumaran-5-ylthiazol-2-yl)-5-(methylthio)-2-nitro-benzamide Formula: C19H15N3O4S2 MolecularWeight: 413.4701

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC(=C(C=C1)[N+](=O)[O-])C(=O)NC2=NC(=CS2)C3=CC4=C(C=C3)OCC4

Isomeric SMILES

CSC1=CC(=C(C=C1)[N+](=O)[O-])C(=O)NC2=NC(=CS2)C3=CC4=C(C=C3)OCC4

InChI

InChI=1S/C19H15N3O4S2/c1-27-13-3-4-16(22(24)25)14(9-13)18(23)21-19-20-15(10-28-19)11-2-5-17-12(8-11)6-7-26-17/h2-5,8-10H,6-7H2,1H3,(H,20,21,23)