N-[4-[4-(2,2-dimethylpropanoylamino)phenyl]-1,3-thiazol-2-yl]-1-oxidanylidene-3,4-dihydroisochromene-3-carboxamide

Systemtic Name: N-[4-[4-(2,2-dimethylpropanoylamino)phenyl]-1,3-thiazol-2-yl]-1-oxidanylidene-3,4-dihydroisochromene-3-carboxamide Openeye Name: N-[4-[4-(2,2-dimethylpropanoylamino)phenyl]thiazol-2-yl]-1-oxo-isochromane-3-carboxamide CAS Name: N-[4-[4-[(2,2-dimethyl-1-oxopropyl)amino]phenyl]-2-thiazolyl]-1-oxo-3,4-dihydro-1H-2-benzopyran-3-carboxamide IUPAC Name: N-[4-[4-(2,2-dimethylpropanoylamino)phenyl]-1,3-thiazol-2-yl]-1-oxo-3,4-dihydroisochromene-3-carboxamide Traditional Name: 1-keto-N-[4-[4-(pivaloylamino)phenyl]thiazol-2-yl]isochroman-3-carboxamide Formula: C24H23N3O4S MolecularWeight: 449.52212

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3CC4=CC=CC=C4C(=O)O3

Isomeric SMILES

CC(C)(C)C(=O)NC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3CC4=CC=CC=C4C(=O)O3

InChI

InChI=1S/C24H23N3O4S/c1-24(2,3)22(30)25-16-10-8-14(9-11-16)18-13-32-23(26-18)27-20(28)19-12-15-6-4-5-7-17(15)21(29)31-19/h4-11,13,19H,12H2,1-3H3,(H,25,30)(H,26,27,28)