5-bromanyl-3-methyl-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-1-benzofuran-2-carboxamide

Systemtic Name: 5-bromanyl-3-methyl-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-1-benzofuran-2-carboxamide Openeye Name: 5-bromo-N-(5-isobutyl-1,3,4-thiadiazol-2-yl)-3-methyl-benzofuran-2-carboxamide CAS Name: 5-bromo-3-methyl-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-2-benzofurancarboxamide IUPAC Name: 5-bromo-3-methyl-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-1-benzofuran-2-carboxamide Traditional Name: 5-bromo-N-(5-isobutyl-1,3,4-thiadiazol-2-yl)-3-methyl-coumarilamide Formula: C16H16BrN3O2S MolecularWeight: 394.28614

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C=C(C=C2)Br)C(=O)NC3=NN=C(S3)CC(C)C

Isomeric SMILES

CC1=C(OC2=C1C=C(C=C2)Br)C(=O)NC3=NN=C(S3)CC(C)C

InChI

InChI=1S/C16H16BrN3O2S/c1-8(2)6-13-19-20-16(23-13)18-15(21)14-9(3)11-7-10(17)4-5-12(11)22-14/h4-5,7-8H,6H2,1-3H3,(H,18,20,21)