3,6-dimethyl-1-oxidanylidene-N-[5-(phenylmethyl)-1,3-thiazol-2-yl]-4H-isochromene-3-carboxamide

Systemtic Name: 3,6-dimethyl-1-oxidanylidene-N-[5-(phenylmethyl)-1,3-thiazol-2-yl]-4H-isochromene-3-carboxamide Openeye Name: N-(5-benzylthiazol-2-yl)-3,6-dimethyl-1-oxo-isochromane-3-carboxamide CAS Name: 3,6-dimethyl-1-oxo-N-[5-(phenylmethyl)-2-thiazolyl]-3,4-dihydro-1H-2-benzopyran-3-carboxamide IUPAC Name: N-(5-benzyl-1,3-thiazol-2-yl)-3,6-dimethyl-1-oxo-4H-isochromene-3-carboxamide Traditional Name: N-(5-benzylthiazol-2-yl)-1-keto-3,6-dimethyl-isochroman-3-carboxamide Formula: C22H20N2O3S MolecularWeight: 392.4708

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=O)OC(C2)(C)C(=O)NC3=NC=C(S3)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC2=C(C=C1)C(=O)OC(C2)(C)C(=O)NC3=NC=C(S3)CC4=CC=CC=C4

InChI

InChI=1S/C22H20N2O3S/c1-14-8-9-18-16(10-14)12-22(2,27-19(18)25)20(26)24-21-23-13-17(28-21)11-15-6-4-3-5-7-15/h3-10,13H,11-12H2,1-2H3,(H,23,24,26)