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

Systemtic Name: [4-[(2-azanyl-4-oxidanylidene-1,3-thiazol-5-ylidene)methyl]phenyl] 4-chloranylbenzenesulfonate Openeye Name: [4-[(2-amino-4-oxo-thiazol-5-ylidene)methyl]phenyl] 4-chlorobenzenesulfonate CAS Name: 4-chlorobenzenesulfonic acid [4-[(2-amino-4-oxo-5-thiazolylidene)methyl]phenyl] ester IUPAC Name: [4-[(2-amino-4-oxo-1,3-thiazol-5-ylidene)methyl]phenyl] 4-chlorobenzenesulfonate Traditional Name: 4-chlorobenzenesulfonic acid [4-[(2-amino-4-keto-2-thiazolin-5-ylidene)methyl]phenyl] ester Formula: C16H11ClN2O4S2 MolecularWeight: 394.85254

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=C2C(=O)N=C(S2)N)OS(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC(=CC=C1C=C2C(=O)N=C(S2)N)OS(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C16H11ClN2O4S2/c17-11-3-7-13(8-4-11)25(21,22)23-12-5-1-10(2-6-12)9-14-15(20)19-16(18)24-14/h1-9H,(H2,18,19,20)