1-oxidanylidene-N-[4-(2,4,6-trimethylphenyl)-1,3-thiazol-2-yl]-3,4-dihydroisochromene-3-carboxamide

Systemtic Name: 1-oxidanylidene-N-[4-(2,4,6-trimethylphenyl)-1,3-thiazol-2-yl]-3,4-dihydroisochromene-3-carboxamide Openeye Name: 1-oxo-N-[4-(2,4,6-trimethylphenyl)thiazol-2-yl]isochromane-3-carboxamide CAS Name: 1-oxo-N-[4-(2,4,6-trimethylphenyl)-2-thiazolyl]-3,4-dihydro-1H-2-benzopyran-3-carboxamide IUPAC Name: 1-oxo-N-[4-(2,4,6-trimethylphenyl)-1,3-thiazol-2-yl]-3,4-dihydroisochromene-3-carboxamide Traditional Name: 1-keto-N-(4-mesitylthiazol-2-yl)isochroman-3-carboxamide Formula: C22H20N2O3S MolecularWeight: 392.4708

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)C2=CSC(=N2)NC(=O)C3CC4=CC=CC=C4C(=O)O3)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)C2=CSC(=N2)NC(=O)C3CC4=CC=CC=C4C(=O)O3)C

InChI

InChI=1S/C22H20N2O3S/c1-12-8-13(2)19(14(3)9-12)17-11-28-22(23-17)24-20(25)18-10-15-6-4-5-7-16(15)21(26)27-18/h4-9,11,18H,10H2,1-3H3,(H,23,24,25)