4-methyl-N-[[5-(4-methylsulfanylphenyl)-2,3-dihydro-1-benzofuran-2-yl]methyl]-1,2,3-thiadiazole-5-carboxamide

Systemtic Name: 4-methyl-N-[[5-(4-methylsulfanylphenyl)-2,3-dihydro-1-benzofuran-2-yl]methyl]-1,2,3-thiadiazole-5-carboxamide Openeye Name: 4-methyl-N-[[5-(4-methylsulfanylphenyl)-2,3-dihydrobenzofuran-2-yl]methyl]thiadiazole-5-carboxamide CAS Name: 4-methyl-N-[[5-[4-(methylthio)phenyl]-2,3-dihydrobenzofuran-2-yl]methyl]-5-thiadiazolecarboxamide IUPAC Name: 4-methyl-N-[[5-(4-methylsulfanylphenyl)-2,3-dihydro-1-benzofuran-2-yl]methyl]thiadiazole-5-carboxamide Traditional Name: 4-methyl-N-[[5-[4-(methylthio)phenyl]coumaran-2-yl]methyl]thiadiazole-5-carboxamide Formula: C20H19N3O2S2 MolecularWeight: 397.51376

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SN=N1)C(=O)NCC2CC3=C(O2)C=CC(=C3)C4=CC=C(C=C4)SC

Isomeric SMILES

CC1=C(SN=N1)C(=O)NCC2CC3=C(O2)C=CC(=C3)C4=CC=C(C=C4)SC

InChI

InChI=1S/C20H19N3O2S2/c1-12-19(27-23-22-12)20(24)21-11-16-10-15-9-14(5-8-18(15)25-16)13-3-6-17(26-2)7-4-13/h3-9,16H,10-11H2,1-2H3,(H,21,24)