[2-(4-benzamidophenyl)-2-oxidanylidene-ethyl] 2-[4-(1,3-dithian-2-yl)phenoxy]ethanoate

Systemtic Name: [2-(4-benzamidophenyl)-2-oxidanylidene-ethyl] 2-[4-(1,3-dithian-2-yl)phenoxy]ethanoate Openeye Name: [2-(4-benzamidophenyl)-2-oxo-ethyl] 2-[4-(1,3-dithian-2-yl)phenoxy]acetate CAS Name: 2-[4-(1,3-dithian-2-yl)phenoxy]acetic acid [2-(4-benzamidophenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-benzamidophenyl)-2-oxoethyl] 2-[4-(1,3-dithian-2-yl)phenoxy]acetate Traditional Name: 2-[4-(1,3-dithian-2-yl)phenoxy]acetic acid [2-(4-benzamidophenyl)-2-keto-ethyl] ester Formula: C27H25NO5S2 MolecularWeight: 507.6211

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC(SC1)C2=CC=C(C=C2)OCC(=O)OCC(=O)C3=CC=C(C=C3)NC(=O)C4=CC=CC=C4

Isomeric SMILES

C1CSC(SC1)C2=CC=C(C=C2)OCC(=O)OCC(=O)C3=CC=C(C=C3)NC(=O)C4=CC=CC=C4

InChI

InChI=1S/C27H25NO5S2/c29-24(19-7-11-22(12-8-19)28-26(31)20-5-2-1-3-6-20)17-33-25(30)18-32-23-13-9-21(10-14-23)27-34-15-4-16-35-27/h1-3,5-14,27H,4,15-18H2,(H,28,31)