2-[[4-(1,3-benzothiazol-2-ylsulfanylmethyl)-1,3-thiazol-2-yl]carbamoyl]benzoate

Systemtic Name: 2-[[4-(1,3-benzothiazol-2-ylsulfanylmethyl)-1,3-thiazol-2-yl]carbamoyl]benzoate Openeye Name: 2-[[4-(1,3-benzothiazol-2-ylsulfanylmethyl)thiazol-2-yl]carbamoyl]benzoate CAS Name: 2-[[[4-[(1,3-benzothiazol-2-ylthio)methyl]-2-thiazolyl]amino]-oxomethyl]benzoate IUPAC Name: 2-[[4-(1,3-benzothiazol-2-ylsulfanylmethyl)-1,3-thiazol-2-yl]carbamoyl]benzoate Traditional Name: 2-[[4-[(1,3-benzothiazol-2-ylthio)methyl]thiazol-2-yl]carbamoyl]benzoate Formula: C19H12N3O3S3- MolecularWeight: 426.51188

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NC2=NC(=CS2)CSC3=NC4=CC=CC=C4S3)C(=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NC2=NC(=CS2)CSC3=NC4=CC=CC=C4S3)C(=O)[O-]

InChI

InChI=1S/C19H13N3O3S3/c23-16(12-5-1-2-6-13(12)17(24)25)22-18-20-11(9-26-18)10-27-19-21-14-7-3-4-8-15(14)28-19/h1-9H,10H2,(H,24,25)(H,20,22,23)/p-1