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

Systemtic Name: 3-methyl-N-(5-phenacylsulfanyl-1,3,4-thiadiazol-2-yl)-1-benzofuran-2-carboxamide Openeye Name: 3-methyl-N-(5-phenacylsulfanyl-1,3,4-thiadiazol-2-yl)benzofuran-2-carboxamide CAS Name: 3-methyl-N-[5-(phenacylthio)-1,3,4-thiadiazol-2-yl]-2-benzofurancarboxamide IUPAC Name: 3-methyl-N-(5-phenacylsulfanyl-1,3,4-thiadiazol-2-yl)-1-benzofuran-2-carboxamide Traditional Name: 3-methyl-N-[5-(phenacylthio)-1,3,4-thiadiazol-2-yl]coumarilamide Formula: C20H15N3O3S2 MolecularWeight: 409.4814

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=CC=CC=C12)C(=O)NC3=NN=C(S3)SCC(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=C(OC2=CC=CC=C12)C(=O)NC3=NN=C(S3)SCC(=O)C4=CC=CC=C4

InChI

InChI=1S/C20H15N3O3S2/c1-12-14-9-5-6-10-16(14)26-17(12)18(25)21-19-22-23-20(28-19)27-11-15(24)13-7-3-2-4-8-13/h2-10H,11H2,1H3,(H,21,22,25)