[2-[(2-azanyl-4-oxidanylidene-1,3-thiazol-5-ylidene)methyl]-6-methoxy-phenyl] benzenesulfonate

Systemtic Name: [2-[(2-azanyl-4-oxidanylidene-1,3-thiazol-5-ylidene)methyl]-6-methoxy-phenyl] benzenesulfonate Openeye Name: [2-[(2-amino-4-oxo-thiazol-5-ylidene)methyl]-6-methoxy-phenyl] benzenesulfonate CAS Name: benzenesulfonic acid [2-[(2-amino-4-oxo-5-thiazolylidene)methyl]-6-methoxyphenyl] ester IUPAC Name: [2-[(2-amino-4-oxo-1,3-thiazol-5-ylidene)methyl]-6-methoxyphenyl] benzenesulfonate Traditional Name: benzenesulfonic acid [2-[(2-amino-4-keto-2-thiazolin-5-ylidene)methyl]-6-methoxy-phenyl] ester Formula: C17H14N2O5S2 MolecularWeight: 390.43346

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OS(=O)(=O)C2=CC=CC=C2)C=C3C(=O)N=C(S3)N

Isomeric SMILES

COC1=CC=CC(=C1OS(=O)(=O)C2=CC=CC=C2)C=C3C(=O)N=C(S3)N

InChI

InChI=1S/C17H14N2O5S2/c1-23-13-9-5-6-11(10-14-16(20)19-17(18)25-14)15(13)24-26(21,22)12-7-3-2-4-8-12/h2-10H,1H3,(H2,18,19,20)