(2-oxidanylidene-1,2-diphenyl-ethyl) 5-(1,3-benzothiazol-2-yl)thiophene-2-carboxylate

Systemtic Name: (2-oxidanylidene-1,2-diphenyl-ethyl) 5-(1,3-benzothiazol-2-yl)thiophene-2-carboxylate Openeye Name: (2-oxo-1,2-diphenyl-ethyl) 5-(1,3-benzothiazol-2-yl)thiophene-2-carboxylate CAS Name: 5-(1,3-benzothiazol-2-yl)-2-thiophenecarboxylic acid (2-oxo-1,2-diphenylethyl) ester IUPAC Name: (2-oxo-1,2-diphenylethyl) 5-(1,3-benzothiazol-2-yl)thiophene-2-carboxylate Traditional Name: 5-(1,3-benzothiazol-2-yl)thiophene-2-carboxylic acid desyl ester Formula: C26H17NO3S2 MolecularWeight: 455.54808

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(=O)C2=CC=CC=C2)OC(=O)C3=CC=C(S3)C4=NC5=CC=CC=C5S4

Isomeric SMILES

C1=CC=C(C=C1)C(C(=O)C2=CC=CC=C2)OC(=O)C3=CC=C(S3)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C26H17NO3S2/c28-23(17-9-3-1-4-10-17)24(18-11-5-2-6-12-18)30-26(29)22-16-15-21(31-22)25-27-19-13-7-8-14-20(19)32-25/h1-16,24H