phenacyl 5-(1,3-benzothiazol-2-yl)thiophene-2-carboxylate

Systemtic Name: phenacyl 5-(1,3-benzothiazol-2-yl)thiophene-2-carboxylate Openeye Name: phenacyl 5-(1,3-benzothiazol-2-yl)thiophene-2-carboxylate CAS Name: 5-(1,3-benzothiazol-2-yl)-2-thiophenecarboxylic acid phenacyl ester IUPAC Name: phenacyl 5-(1,3-benzothiazol-2-yl)thiophene-2-carboxylate Traditional Name: 5-(1,3-benzothiazol-2-yl)thiophene-2-carboxylic acid phenacyl ester Formula: C20H13NO3S2 MolecularWeight: 379.45212

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)COC(=O)C2=CC=C(S2)C3=NC4=CC=CC=C4S3

Isomeric SMILES

C1=CC=C(C=C1)C(=O)COC(=O)C2=CC=C(S2)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C20H13NO3S2/c22-15(13-6-2-1-3-7-13)12-24-20(23)18-11-10-17(25-18)19-21-14-8-4-5-9-16(14)26-19/h1-11H,12H2