4-[(5-fluoranyl-1,3-benzothiazol-2-yl)methoxy]-2-methyl-3-(4-oxidanyl-3,4-dihydro-2H-chromen-3-yl)benzamide

Systemtic Name: 4-[(5-fluoranyl-1,3-benzothiazol-2-yl)methoxy]-2-methyl-3-(4-oxidanyl-3,4-dihydro-2H-chromen-3-yl)benzamide Openeye Name: 4-[(5-fluoro-1,3-benzothiazol-2-yl)methoxy]-3-(4-hydroxychroman-3-yl)-2-methyl-benzamide CAS Name: 4-[(5-fluoro-1,3-benzothiazol-2-yl)methoxy]-3-(4-hydroxy-3,4-dihydro-2H-1-benzopyran-3-yl)-2-methylbenzamide IUPAC Name: 4-[(5-fluoro-1,3-benzothiazol-2-yl)methoxy]-3-(4-hydroxy-3,4-dihydro-2H-chromen-3-yl)-2-methylbenzamide Traditional Name: 4-[(5-fluoro-1,3-benzothiazol-2-yl)methoxy]-3-(4-hydroxychroman-3-yl)-2-methyl-benzamide Formula: C25H21FN2O4S MolecularWeight: 464.508643

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1C2COC3=CC=CC=C3C2O)OCC4=NC5=C(S4)C=CC(=C5)F)C(=O)N

Isomeric SMILES

CC1=C(C=CC(=C1C2COC3=CC=CC=C3C2O)OCC4=NC5=C(S4)C=CC(=C5)F)C(=O)N

InChI

InChI=1S/C25H21FN2O4S/c1-13-15(25(27)30)7-8-20(32-12-22-28-18-10-14(26)6-9-21(18)33-22)23(13)17-11-31-19-5-3-2-4-16(19)24(17)29/h2-10,17,24,29H,11-12H2,1H3,(H2,27,30)