4-[2-methoxy-4-[(E)-(4-oxidanidyl-2-sulfanylidene-1,3-thiazol-5-ylidene)methyl]phenoxy]butanoate

Systemtic Name: 4-[2-methoxy-4-[(E)-(4-oxidanidyl-2-sulfanylidene-1,3-thiazol-5-ylidene)methyl]phenoxy]butanoate Openeye Name: 4-[2-methoxy-4-[(E)-(4-oxido-2-thioxo-thiazol-5-ylidene)methyl]phenoxy]butanoate CAS Name: 4-[2-methoxy-4-[(E)-(4-oxido-2-sulfanylidene-5-thiazolylidene)methyl]phenoxy]butanoate IUPAC Name: 4-[2-methoxy-4-[(E)-(4-oxido-2-sulfanylidene-1,3-thiazol-5-ylidene)methyl]phenoxy]butanoate Traditional Name: 4-[2-methoxy-4-[(E)-(4-oxido-2-thioxo-3-thiazolin-5-ylidene)methyl]phenoxy]butyrate Formula: C15H13NO5S2-2 MolecularWeight: 351.39742

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=C2C(=NC(=S)S2)[O-])OCCCC(=O)[O-]

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C/2\C(=NC(=S)S2)[O-])OCCCC(=O)[O-]

InChI

InChI=1S/C15H15NO5S2/c1-20-11-7-9(8-12-14(19)16-15(22)23-12)4-5-10(11)21-6-2-3-13(17)18/h4-5,7-8H,2-3,6H2,1H3,(H,17,18)(H,16,19,22)/p-2/b12-8+