N-[5-[(4-methoxyphenyl)methyl]-1,3-thiazol-2-yl]-6-methyl-1-oxidanylidene-3,4-dihydroisochromene-3-carboxamide

Systemtic Name: N-[5-[(4-methoxyphenyl)methyl]-1,3-thiazol-2-yl]-6-methyl-1-oxidanylidene-3,4-dihydroisochromene-3-carboxamide Openeye Name: N-[5-[(4-methoxyphenyl)methyl]thiazol-2-yl]-6-methyl-1-oxo-isochromane-3-carboxamide CAS Name: N-[5-[(4-methoxyphenyl)methyl]-2-thiazolyl]-6-methyl-1-oxo-3,4-dihydro-1H-2-benzopyran-3-carboxamide IUPAC Name: N-[5-[(4-methoxyphenyl)methyl]-1,3-thiazol-2-yl]-6-methyl-1-oxo-3,4-dihydroisochromene-3-carboxamide Traditional Name: 1-keto-6-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=C(C=C1)C(=O)OC(C2)C(=O)NC3=NC=C(S3)CC4=CC=C(C=C4)OC

Isomeric SMILES

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

InChI

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