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

Systemtic Name: 3,6-dimethyl-N-(5-prop-2-enylsulfanyl-1,3,4-thiadiazol-2-yl)-1-benzofuran-2-carboxamide Openeye Name: N-(5-allylsulfanyl-1,3,4-thiadiazol-2-yl)-3,6-dimethyl-benzofuran-2-carboxamide CAS Name: 3,6-dimethyl-N-[5-(prop-2-enylthio)-1,3,4-thiadiazol-2-yl]-2-benzofurancarboxamide IUPAC Name: 3,6-dimethyl-N-(5-prop-2-enylsulfanyl-1,3,4-thiadiazol-2-yl)-1-benzofuran-2-carboxamide Traditional Name: N-[5-(allylthio)-1,3,4-thiadiazol-2-yl]-3,6-dimethyl-coumarilamide Formula: C16H15N3O2S2 MolecularWeight: 345.4392

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=C(O2)C(=O)NC3=NN=C(S3)SCC=C)C

Isomeric SMILES

CC1=CC2=C(C=C1)C(=C(O2)C(=O)NC3=NN=C(S3)SCC=C)C

InChI

InChI=1S/C16H15N3O2S2/c1-4-7-22-16-19-18-15(23-16)17-14(20)13-10(3)11-6-5-9(2)8-12(11)21-13/h4-6,8H,1,7H2,2-3H3,(H,17,18,20)