2-(4-carbamothioylphenyl)carbonyl-4-[4-(2-ethoxy-2-oxidanylidene-ethoxy)phenyl]-4-oxidanylidene-butanoate

Systemtic Name: 2-(4-carbamothioylphenyl)carbonyl-4-[4-(2-ethoxy-2-oxidanylidene-ethoxy)phenyl]-4-oxidanylidene-butanoate Openeye Name: 2-(4-carbamothioylbenzoyl)-4-[4-(2-ethoxy-2-oxo-ethoxy)phenyl]-4-oxo-butanoate CAS Name: 2-[(4-carbamothioylphenyl)-oxomethyl]-4-[4-(2-ethoxy-2-oxoethoxy)phenyl]-4-oxobutanoate IUPAC Name: 2-(4-carbamothioylbenzoyl)-4-[4-(2-ethoxy-2-oxoethoxy)phenyl]-4-oxobutanoate Traditional Name: 4-[4-(2-ethoxy-2-keto-ethoxy)phenyl]-4-keto-2-(4-thiocarbamoylbenzoyl)butyrate Formula: C22H20NO7S- MolecularWeight: 442.4617

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)COC1=CC=C(C=C1)C(=O)CC(C(=O)C2=CC=C(C=C2)C(=S)N)C(=O)[O-]

Isomeric SMILES

CCOC(=O)COC1=CC=C(C=C1)C(=O)CC(C(=O)C2=CC=C(C=C2)C(=S)N)C(=O)[O-]

InChI

InChI=1S/C22H21NO7S/c1-2-29-19(25)12-30-16-9-7-13(8-10-16)18(24)11-17(22(27)28)20(26)14-3-5-15(6-4-14)21(23)31/h3-10,17H,2,11-12H2,1H3,(H2,23,31)(H,27,28)/p-1