[4-[(2-azanyl-4-oxidanylidene-1,3-thiazol-5-ylidene)methyl]-2-ethoxy-phenyl] 4-acetamidobenzenesulfonate

Systemtic Name: [4-[(2-azanyl-4-oxidanylidene-1,3-thiazol-5-ylidene)methyl]-2-ethoxy-phenyl] 4-acetamidobenzenesulfonate Openeye Name: [4-[(2-amino-4-oxo-thiazol-5-ylidene)methyl]-2-ethoxy-phenyl] 4-acetamidobenzenesulfonate CAS Name: 4-acetamidobenzenesulfonic acid [4-[(2-amino-4-oxo-5-thiazolylidene)methyl]-2-ethoxyphenyl] ester IUPAC Name: [4-[(2-amino-4-oxo-1,3-thiazol-5-ylidene)methyl]-2-ethoxyphenyl] 4-acetamidobenzenesulfonate Traditional Name: 4-acetamidobenzenesulfonic acid [4-[(2-amino-4-keto-2-thiazolin-5-ylidene)methyl]-2-ethoxy-phenyl] ester Formula: C20H19N3O6S2 MolecularWeight: 461.51136

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=C2C(=O)N=C(S2)N)OS(=O)(=O)C3=CC=C(C=C3)NC(=O)C

Isomeric SMILES

CCOC1=C(C=CC(=C1)C=C2C(=O)N=C(S2)N)OS(=O)(=O)C3=CC=C(C=C3)NC(=O)C

InChI

InChI=1S/C20H19N3O6S2/c1-3-28-17-10-13(11-18-19(25)23-20(21)30-18)4-9-16(17)29-31(26,27)15-7-5-14(6-8-15)22-12(2)24/h4-11H,3H2,1-2H3,(H,22,24)(H2,21,23,25)