[4-(thiophen-2-ylcarbonylamino)phenyl] 2-(1,3-benzothiazol-2-ylsulfanyl)ethanoate

Systemtic Name: [4-(thiophen-2-ylcarbonylamino)phenyl] 2-(1,3-benzothiazol-2-ylsulfanyl)ethanoate Openeye Name: [4-(thiophene-2-carbonylamino)phenyl] 2-(1,3-benzothiazol-2-ylsulfanyl)acetate CAS Name: 2-(1,3-benzothiazol-2-ylthio)acetic acid [4-[[oxo(thiophen-2-yl)methyl]amino]phenyl] ester IUPAC Name: [4-(thiophene-2-carbonylamino)phenyl] 2-(1,3-benzothiazol-2-ylsulfanyl)acetate Traditional Name: 2-(1,3-benzothiazol-2-ylthio)acetic acid [4-(2-thenoylamino)phenyl] ester Formula: C20H14N2O3S3 MolecularWeight: 426.53176

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)SCC(=O)OC3=CC=C(C=C3)NC(=O)C4=CC=CS4

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)SCC(=O)OC3=CC=C(C=C3)NC(=O)C4=CC=CS4

InChI

InChI=1S/C20H14N2O3S3/c23-18(12-27-20-22-15-4-1-2-5-16(15)28-20)25-14-9-7-13(8-10-14)21-19(24)17-6-3-11-26-17/h1-11H,12H2,(H,21,24)