3-(2-fluoranyl-6a,7-dihydro-6H-chromeno[3,4-c][1,5]benzothiazepin-7-yl)chromen-4-one

Systemtic Name: 3-(2-fluoranyl-6a,7-dihydro-6H-chromeno[3,4-c][1,5]benzothiazepin-7-yl)chromen-4-one Openeye Name: 3-(2-fluoro-6a,7-dihydro-6H-chromeno[3,4-c][1,5]benzothiazepin-7-yl)chromen-4-one CAS Name: 3-(2-fluoro-6a,7-dihydro-6H-[1]benzopyrano[3,4-c][1,5]benzothiazepin-7-yl)-1-benzopyran-4-one IUPAC Name: 3-(2-fluoro-6a,7-dihydro-6H-chromeno[3,4-c][1,5]benzothiazepin-7-yl)chromen-4-one Traditional Name: 3-(2-fluoro-6a,7-dihydro-6H-chromeno[3,4-c][1,5]benzothiazepin-7-yl)chromone Formula: C25H16FNO3S MolecularWeight: 429.462843

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Descriptors Computed from Structure

Canonical SMILES:

C1C2C(SC3=CC=CC=C3N=C2C4=C(O1)C=CC(=C4)F)C5=COC6=CC=CC=C6C5=O

Isomeric SMILES

C1C2C(SC3=CC=CC=C3N=C2C4=C(O1)C=CC(=C4)F)C5=COC6=CC=CC=C6C5=O

InChI

InChI=1S/C25H16FNO3S/c26-14-9-10-21-16(11-14)23-17(12-29-21)25(31-22-8-4-2-6-19(22)27-23)18-13-30-20-7-3-1-5-15(20)24(18)28/h1-11,13,17,25H,12H2