(2S)-2-(1,3-benzothiazol-2-ylsulfanyl)-N-(3-ethanoylphenyl)-2-phenyl-ethanamide

Systemtic Name: (2S)-2-(1,3-benzothiazol-2-ylsulfanyl)-N-(3-ethanoylphenyl)-2-phenyl-ethanamide Openeye Name: (2S)-N-(3-acetylphenyl)-2-(1,3-benzothiazol-2-ylsulfanyl)-2-phenyl-acetamide CAS Name: (2S)-N-(3-acetylphenyl)-2-(1,3-benzothiazol-2-ylthio)-2-phenylacetamide IUPAC Name: (2S)-N-(3-acetylphenyl)-2-(1,3-benzothiazol-2-ylsulfanyl)-2-phenylacetamide Traditional Name: (2S)-N-(3-acetylphenyl)-2-(1,3-benzothiazol-2-ylthio)-2-phenyl-acetamide Formula: C23H18N2O2S2 MolecularWeight: 418.53122

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)NC(=O)C(C2=CC=CC=C2)SC3=NC4=CC=CC=C4S3

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)NC(=O)[C@H](C2=CC=CC=C2)SC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C23H18N2O2S2/c1-15(26)17-10-7-11-18(14-17)24-22(27)21(16-8-3-2-4-9-16)29-23-25-19-12-5-6-13-20(19)28-23/h2-14,21H,1H3,(H,24,27)/t21-/m0/s1