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

Systemtic Name: [4-[(2-azanyl-4-oxidanylidene-1,3-thiazol-5-ylidene)methyl]-2-bromanyl-phenyl] 4-chloranylbenzoate Openeye Name: [4-[(2-amino-4-oxo-thiazol-5-ylidene)methyl]-2-bromo-phenyl] 4-chlorobenzoate CAS Name: 4-chlorobenzoic acid [4-[(2-amino-4-oxo-5-thiazolylidene)methyl]-2-bromophenyl] ester IUPAC Name: [4-[(2-amino-4-oxo-1,3-thiazol-5-ylidene)methyl]-2-bromophenyl] 4-chlorobenzoate Traditional Name: 4-chlorobenzoic acid [4-[(2-amino-4-keto-2-thiazolin-5-ylidene)methyl]-2-bromo-phenyl] ester Formula: C17H10BrClN2O3S MolecularWeight: 437.6949

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)OC2=C(C=C(C=C2)C=C3C(=O)N=C(S3)N)Br)Cl

Isomeric SMILES

C1=CC(=CC=C1C(=O)OC2=C(C=C(C=C2)C=C3C(=O)N=C(S3)N)Br)Cl

InChI

InChI=1S/C17H10BrClN2O3S/c18-12-7-9(8-14-15(22)21-17(20)25-14)1-6-13(12)24-16(23)10-2-4-11(19)5-3-10/h1-8H,(H2,20,21,22)