N-(5-butylsulfanyl-1,3,4-thiadiazol-2-yl)-3,6-dimethyl-1-benzofuran-2-carboxamide

Systemtic Name: N-(5-butylsulfanyl-1,3,4-thiadiazol-2-yl)-3,6-dimethyl-1-benzofuran-2-carboxamide Openeye Name: N-(5-butylsulfanyl-1,3,4-thiadiazol-2-yl)-3,6-dimethyl-benzofuran-2-carboxamide CAS Name: N-[5-(butylthio)-1,3,4-thiadiazol-2-yl]-3,6-dimethyl-2-benzofurancarboxamide IUPAC Name: N-(5-butylsulfanyl-1,3,4-thiadiazol-2-yl)-3,6-dimethyl-1-benzofuran-2-carboxamide Traditional Name: N-[5-(butylthio)-1,3,4-thiadiazol-2-yl]-3,6-dimethyl-coumarilamide Formula: C17H19N3O2S2 MolecularWeight: 361.48166

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H19N3O2S2/c1-4-5-8-23-17-20-19-16(24-17)18-15(21)14-11(3)12-7-6-10(2)9-13(12)22-14/h6-7,9H,4-5,8H2,1-3H3,(H,18,19,21)