N-[5-[(4-methoxyphenyl)methyl]-1,3-thiazol-2-yl]-3-methyl-1-oxidanylidene-4H-isochromene-3-carboxamide

Systemtic Name: N-[5-[(4-methoxyphenyl)methyl]-1,3-thiazol-2-yl]-3-methyl-1-oxidanylidene-4H-isochromene-3-carboxamide Openeye Name: N-[5-[(4-methoxyphenyl)methyl]thiazol-2-yl]-3-methyl-1-oxo-isochromane-3-carboxamide CAS Name: N-[5-[(4-methoxyphenyl)methyl]-2-thiazolyl]-3-methyl-1-oxo-3,4-dihydro-1H-2-benzopyran-3-carboxamide IUPAC Name: N-[5-[(4-methoxyphenyl)methyl]-1,3-thiazol-2-yl]-3-methyl-1-oxo-4H-isochromene-3-carboxamide Traditional Name: 1-keto-3-methyl-N-(5-p-anisylthiazol-2-yl)isochroman-3-carboxamide Formula: C22H20N2O4S MolecularWeight: 408.4702

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=CC=CC=C2C(=O)O1)C(=O)NC3=NC=C(S3)CC4=CC=C(C=C4)OC

Isomeric SMILES

CC1(CC2=CC=CC=C2C(=O)O1)C(=O)NC3=NC=C(S3)CC4=CC=C(C=C4)OC

InChI

InChI=1S/C22H20N2O4S/c1-22(12-15-5-3-4-6-18(15)19(25)28-22)20(26)24-21-23-13-17(29-21)11-14-7-9-16(27-2)10-8-14/h3-10,13H,11-12H2,1-2H3,(H,23,24,26)