2-[2-[(2-methylsulfanyl-1,3-benzothiazol-6-yl)amino]-2-oxidanylidene-ethyl]sulfanyl-N-phenyl-ethanamide

Systemtic Name: 2-[2-[(2-methylsulfanyl-1,3-benzothiazol-6-yl)amino]-2-oxidanylidene-ethyl]sulfanyl-N-phenyl-ethanamide Openeye Name: 2-[2-[(2-methylsulfanyl-1,3-benzothiazol-6-yl)amino]-2-oxo-ethyl]sulfanyl-N-phenyl-acetamide CAS Name: 2-[[2-[[2-(methylthio)-1,3-benzothiazol-6-yl]amino]-2-oxoethyl]thio]-N-phenylacetamide IUPAC Name: 2-[2-[(2-methylsulfanyl-1,3-benzothiazol-6-yl)amino]-2-oxoethyl]sulfanyl-N-phenylacetamide Traditional Name: 2-[[2-keto-2-[[2-(methylthio)-1,3-benzothiazol-6-yl]amino]ethyl]thio]-N-phenyl-acetamide Formula: C18H17N3O2S3 MolecularWeight: 403.54148

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC2=C(S1)C=C(C=C2)NC(=O)CSCC(=O)NC3=CC=CC=C3

Isomeric SMILES

CSC1=NC2=C(S1)C=C(C=C2)NC(=O)CSCC(=O)NC3=CC=CC=C3

InChI

InChI=1S/C18H17N3O2S3/c1-24-18-21-14-8-7-13(9-15(14)26-18)20-17(23)11-25-10-16(22)19-12-5-3-2-4-6-12/h2-9H,10-11H2,1H3,(H,19,22)(H,20,23)