7-[2-oxidanyl-3-(thiolan-3-ylamino)propoxy]-2-phenyl-chromen-4-one hydrochloride

Systemtic Name: 7-[2-oxidanyl-3-(thiolan-3-ylamino)propoxy]-2-phenyl-chromen-4-one hydrochloride Openeye Name: 7-[2-hydroxy-3-(tetrahydrothiophen-3-ylamino)propoxy]-2-phenyl-chromen-4-one hydrochloride CAS Name: 7-[2-hydroxy-3-(3-thiolanylamino)propoxy]-2-phenyl-1-benzopyran-4-one hydrochloride IUPAC Name: 7-[2-hydroxy-3-(thiolan-3-ylamino)propoxy]-2-phenylchromen-4-one hydrochloride Traditional Name: 7-[2-hydroxy-3-(tetrahydrothiophen-3-ylamino)propoxy]-2-phenyl-chromone hydrochloride Formula: C22H24ClNO4S MolecularWeight: 433.94826

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CSCC1NCC(COC2=CC3=C(C=C2)C(=O)C=C(O3)C4=CC=CC=C4)O.Cl

Isomeric SMILES

C1CSCC1NCC(COC2=CC3=C(C=C2)C(=O)C=C(O3)C4=CC=CC=C4)O.Cl

InChI

InChI=1S/C22H23NO4S.ClH/c24-17(12-23-16-8-9-28-14-16)13-26-18-6-7-19-20(25)11-21(27-22(19)10-18)15-4-2-1-3-5-15;/h1-7,10-11,16-17,23-24H,8-9,12-14H2;1H