3,5,7-trimethyl-N-(5-prop-2-enylsulfanyl-1,3,4-thiadiazol-2-yl)-1-benzofuran-2-carboxamide

Systemtic Name: 3,5,7-trimethyl-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)-3,5,7-trimethyl-benzofuran-2-carboxamide CAS Name: 3,5,7-trimethyl-N-[5-(prop-2-enylthio)-1,3,4-thiadiazol-2-yl]-2-benzofurancarboxamide IUPAC Name: 3,5,7-trimethyl-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]-3,5,7-trimethyl-coumarilamide Formula: C17H17N3O2S2 MolecularWeight: 359.46578

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(=C(O2)C(=O)NC3=NN=C(S3)SCC=C)C)C

Isomeric SMILES

CC1=CC(=C2C(=C1)C(=C(O2)C(=O)NC3=NN=C(S3)SCC=C)C)C

InChI

InChI=1S/C17H17N3O2S2/c1-5-6-23-17-20-19-16(24-17)18-15(21)14-11(4)12-8-9(2)7-10(3)13(12)22-14/h5,7-8H,1,6H2,2-4H3,(H,18,19,21)