1-oxidanylidene-N-[3-(2-oxidanylidenepropyl)-1,2,4-thiadiazol-5-yl]-3,4-dihydroisochromene-3-carboxamide

Systemtic Name: 1-oxidanylidene-N-[3-(2-oxidanylidenepropyl)-1,2,4-thiadiazol-5-yl]-3,4-dihydroisochromene-3-carboxamide Openeye Name: N-(3-acetonyl-1,2,4-thiadiazol-5-yl)-1-oxo-isochromane-3-carboxamide CAS Name: 1-oxo-N-[3-(2-oxopropyl)-1,2,4-thiadiazol-5-yl]-3,4-dihydro-1H-2-benzopyran-3-carboxamide IUPAC Name: 1-oxo-N-[3-(2-oxopropyl)-1,2,4-thiadiazol-5-yl]-3,4-dihydroisochromene-3-carboxamide Traditional Name: N-(3-acetonyl-1,2,4-thiadiazol-5-yl)-1-keto-isochroman-3-carboxamide Formula: C15H13N3O4S MolecularWeight: 331.34642

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC1=NSC(=N1)NC(=O)C2CC3=CC=CC=C3C(=O)O2

Isomeric SMILES

CC(=O)CC1=NSC(=N1)NC(=O)C2CC3=CC=CC=C3C(=O)O2

InChI

InChI=1S/C15H13N3O4S/c1-8(19)6-12-16-15(23-18-12)17-13(20)11-7-9-4-2-3-5-10(9)14(21)22-11/h2-5,11H,6-7H2,1H3,(H,16,17,18,20)