6-bromanyl-1-oxidanylidene-N-(5-propylsulfanyl-1,3,4-thiadiazol-2-yl)-3,4-dihydroisochromene-3-carboxamide

Systemtic Name: 6-bromanyl-1-oxidanylidene-N-(5-propylsulfanyl-1,3,4-thiadiazol-2-yl)-3,4-dihydroisochromene-3-carboxamide Openeye Name: 6-bromo-1-oxo-N-(5-propylsulfanyl-1,3,4-thiadiazol-2-yl)isochromane-3-carboxamide CAS Name: 6-bromo-1-oxo-N-[5-(propylthio)-1,3,4-thiadiazol-2-yl]-3,4-dihydro-1H-2-benzopyran-3-carboxamide IUPAC Name: 6-bromo-1-oxo-N-(5-propylsulfanyl-1,3,4-thiadiazol-2-yl)-3,4-dihydroisochromene-3-carboxamide Traditional Name: 6-bromo-1-keto-N-[5-(propylthio)-1,3,4-thiadiazol-2-yl]isochroman-3-carboxamide Formula: C15H14BrN3O3S2 MolecularWeight: 428.32396

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NN=C(S1)NC(=O)C2CC3=C(C=CC(=C3)Br)C(=O)O2

Isomeric SMILES

CCCSC1=NN=C(S1)NC(=O)C2CC3=C(C=CC(=C3)Br)C(=O)O2

InChI

InChI=1S/C15H14BrN3O3S2/c1-2-5-23-15-19-18-14(24-15)17-12(20)11-7-8-6-9(16)3-4-10(8)13(21)22-11/h3-4,6,11H,2,5,7H2,1H3,(H,17,18,20)