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

Systemtic Name: 1-oxidanylidene-N-(5-propylsulfanyl-1,3,4-thiadiazol-2-yl)-3,4-dihydroisochromene-3-carboxamide Openeye Name: 1-oxo-N-(5-propylsulfanyl-1,3,4-thiadiazol-2-yl)isochromane-3-carboxamide CAS Name: 1-oxo-N-[5-(propylthio)-1,3,4-thiadiazol-2-yl]-3,4-dihydro-1H-2-benzopyran-3-carboxamide IUPAC Name: 1-oxo-N-(5-propylsulfanyl-1,3,4-thiadiazol-2-yl)-3,4-dihydroisochromene-3-carboxamide Traditional Name: 1-keto-N-[5-(propylthio)-1,3,4-thiadiazol-2-yl]isochroman-3-carboxamide Formula: C15H15N3O3S2 MolecularWeight: 349.4279

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NN=C(S1)NC(=O)C2CC3=CC=CC=C3C(=O)O2

Isomeric SMILES

CCCSC1=NN=C(S1)NC(=O)C2CC3=CC=CC=C3C(=O)O2

InChI

InChI=1S/C15H15N3O3S2/c1-2-7-22-15-18-17-14(23-15)16-12(19)11-8-9-5-3-4-6-10(9)13(20)21-11/h3-6,11H,2,7-8H2,1H3,(H,16,17,19)