2-(1,3-benzothiazol-2-ylsulfanyl)-N-(4-propanoylphenyl)ethanamide

Systemtic Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-(4-propanoylphenyl)ethanamide Openeye Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-(4-propanoylphenyl)acetamide CAS Name: 2-(1,3-benzothiazol-2-ylthio)-N-[4-(1-oxopropyl)phenyl]acetamide IUPAC Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-(4-propanoylphenyl)acetamide Traditional Name: 2-(1,3-benzothiazol-2-ylthio)-N-(4-propionylphenyl)acetamide Formula: C18H16N2O2S2 MolecularWeight: 356.46184

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3S2

Isomeric SMILES

CCC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C18H16N2O2S2/c1-2-15(21)12-7-9-13(10-8-12)19-17(22)11-23-18-20-14-5-3-4-6-16(14)24-18/h3-10H,2,11H2,1H3,(H,19,22)