2-[(5Z)-5-[[4-[4-[(2S)-2-azanyl-3-methoxy-3-oxidanylidene-propyl]phenoxy]-3-(trifluoromethyl)phenyl]methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]ethanoic acid hydrochloride

Systemtic Name: 2-[(5Z)-5-[[4-[4-[(2S)-2-azanyl-3-methoxy-3-oxidanylidene-propyl]phenoxy]-3-(trifluoromethyl)phenyl]methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]ethanoic acid hydrochloride Openeye Name: 2-[(5Z)-5-[[4-[4-[(2S)-2-amino-3-methoxy-3-oxo-propyl]phenoxy]-3-(trifluoromethyl)phenyl]methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]acetic acid hydrochloride CAS Name: 2-[(5Z)-5-[[4-[4-[(2S)-2-amino-3-methoxy-3-oxopropyl]phenoxy]-3-(trifluoromethyl)phenyl]methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]acetic acid hydrochloride IUPAC Name: 2-[(5Z)-5-[[4-[4-[(2S)-2-amino-3-methoxy-3-oxopropyl]phenoxy]-3-(trifluoromethyl)phenyl]methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetic acid hydrochloride Traditional Name: 2-[(5Z)-5-[4-[4-[(2S)-2-amino-3-keto-3-methoxy-propyl]phenoxy]-3-(trifluoromethyl)benzylidene]-4-keto-2-thioxo-thiazolidin-3-yl]acetic acid hydrochloride Formula: C23H20ClF3N2O6S2 MolecularWeight: 576.99291

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=C(C=C1)OC2=C(C=C(C=C2)C=C3C(=O)N(C(=S)S3)CC(=O)O)C(F)(F)F)N.Cl

Isomeric SMILES

COC(=O)[C@H](CC1=CC=C(C=C1)OC2=C(C=C(C=C2)/C=C\3/C(=O)N(C(=S)S3)CC(=O)O)C(F)(F)F)N.Cl

InChI

InChI=1S/C23H19F3N2O6S2.ClH/c1-33-21(32)16(27)9-12-2-5-14(6-3-12)34-17-7-4-13(8-15(17)23(24,25)26)10-18-20(31)28(11-19(29)30)22(35)36-18;/h2-8,10,16H,9,11,27H2,1H3,(H,29,30);1H/b18-10-;/t16-;/m0./s1