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

Systemtic Name: 1-oxidanylidene-N-(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)-3,4-dihydroisochromene-3-carboxamide Openeye Name: N-[5-(1-ethylpropyl)-1,3,4-thiadiazol-2-yl]-1-oxo-isochromane-3-carboxamide CAS Name: 1-oxo-N-(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)-3,4-dihydro-1H-2-benzopyran-3-carboxamide IUPAC Name: 1-oxo-N-(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)-3,4-dihydroisochromene-3-carboxamide Traditional Name: N-[5-(1-ethylpropyl)-1,3,4-thiadiazol-2-yl]-1-keto-isochroman-3-carboxamide Formula: C17H19N3O3S MolecularWeight: 345.41606

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C1=NN=C(S1)NC(=O)C2CC3=CC=CC=C3C(=O)O2

Isomeric SMILES

CCC(CC)C1=NN=C(S1)NC(=O)C2CC3=CC=CC=C3C(=O)O2

InChI

InChI=1S/C17H19N3O3S/c1-3-10(4-2)15-19-20-17(24-15)18-14(21)13-9-11-7-5-6-8-12(11)16(22)23-13/h5-8,10,13H,3-4,9H2,1-2H3,(H,18,20,21)