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

Systemtic Name: N-[5-[(4-fluorophenyl)methyl]-1,3-thiazol-2-yl]-6-methyl-1-oxidanylidene-3,4-dihydroisochromene-3-carboxamide Openeye Name: N-[5-[(4-fluorophenyl)methyl]thiazol-2-yl]-6-methyl-1-oxo-isochromane-3-carboxamide CAS Name: N-[5-[(4-fluorophenyl)methyl]-2-thiazolyl]-6-methyl-1-oxo-3,4-dihydro-1H-2-benzopyran-3-carboxamide IUPAC Name: N-[5-[(4-fluorophenyl)methyl]-1,3-thiazol-2-yl]-6-methyl-1-oxo-3,4-dihydroisochromene-3-carboxamide Traditional Name: N-[5-(4-fluorobenzyl)thiazol-2-yl]-1-keto-6-methyl-isochroman-3-carboxamide Formula: C21H17FN2O3S MolecularWeight: 396.434683

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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)F

Isomeric SMILES

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

InChI

InChI=1S/C21H17FN2O3S/c1-12-2-7-17-14(8-12)10-18(27-20(17)26)19(25)24-21-23-11-16(28-21)9-13-3-5-15(22)6-4-13/h2-8,11,18H,9-10H2,1H3,(H,23,24,25)