N-(3-chloranyl-2-morpholin-4-yl-phenyl)-3-(1H-1,2,4-triazol-5-ylsulfanylmethyl)-1-benzofuran-2-carboxamide

Systemtic Name: N-(3-chloranyl-2-morpholin-4-yl-phenyl)-3-(1H-1,2,4-triazol-5-ylsulfanylmethyl)-1-benzofuran-2-carboxamide Openeye Name: N-(3-chloro-2-morpholino-phenyl)-3-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzofuran-2-carboxamide CAS Name: N-[3-chloro-2-(4-morpholinyl)phenyl]-3-[(1H-1,2,4-triazol-5-ylthio)methyl]-2-benzofurancarboxamide IUPAC Name: N-(3-chloro-2-morpholin-4-ylphenyl)-3-(1H-1,2,4-triazol-5-ylsulfanylmethyl)-1-benzofuran-2-carboxamide Traditional Name: N-(3-chloro-2-morpholino-phenyl)-3-[(1H-1,2,4-triazol-5-ylthio)methyl]coumarilamide Formula: C22H20ClN5O3S MolecularWeight: 469.9439

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=CC=C2Cl)NC(=O)C3=C(C4=CC=CC=C4O3)CSC5=NC=NN5

Isomeric SMILES

C1COCCN1C2=C(C=CC=C2Cl)NC(=O)C3=C(C4=CC=CC=C4O3)CSC5=NC=NN5

InChI

InChI=1S/C22H20ClN5O3S/c23-16-5-3-6-17(19(16)28-8-10-30-11-9-28)26-21(29)20-15(12-32-22-24-13-25-27-22)14-4-1-2-7-18(14)31-20/h1-7,13H,8-12H2,(H,26,29)(H,24,25,27)