N-(5-butylsulfanyl-1,3,4-thiadiazol-2-yl)-5-ethyl-3-methyl-1-benzofuran-2-carboxamide

Systemtic Name: N-(5-butylsulfanyl-1,3,4-thiadiazol-2-yl)-5-ethyl-3-methyl-1-benzofuran-2-carboxamide Openeye Name: N-(5-butylsulfanyl-1,3,4-thiadiazol-2-yl)-5-ethyl-3-methyl-benzofuran-2-carboxamide CAS Name: N-[5-(butylthio)-1,3,4-thiadiazol-2-yl]-5-ethyl-3-methyl-2-benzofurancarboxamide IUPAC Name: N-(5-butylsulfanyl-1,3,4-thiadiazol-2-yl)-5-ethyl-3-methyl-1-benzofuran-2-carboxamide Traditional Name: N-[5-(butylthio)-1,3,4-thiadiazol-2-yl]-5-ethyl-3-methyl-coumarilamide Formula: C18H21N3O2S2 MolecularWeight: 375.50824

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=NN=C(S1)NC(=O)C2=C(C3=C(O2)C=CC(=C3)CC)C

Isomeric SMILES

CCCCSC1=NN=C(S1)NC(=O)C2=C(C3=C(O2)C=CC(=C3)CC)C

InChI

InChI=1S/C18H21N3O2S2/c1-4-6-9-24-18-21-20-17(25-18)19-16(22)15-11(3)13-10-12(5-2)7-8-14(13)23-15/h7-8,10H,4-6,9H2,1-3H3,(H,19,20,22)