N-(1,3-benzothiazol-2-yl)-N-(4-ethanoylphenyl)-4-phenylsulfanyl-butanamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-N-(4-ethanoylphenyl)-4-phenylsulfanyl-butanamide Openeye Name: N-(4-acetylphenyl)-N-(1,3-benzothiazol-2-yl)-4-phenylsulfanyl-butanamide CAS Name: N-(4-acetylphenyl)-N-(1,3-benzothiazol-2-yl)-4-(phenylthio)butanamide IUPAC Name: N-(4-acetylphenyl)-N-(1,3-benzothiazol-2-yl)-4-phenylsulfanylbutanamide Traditional Name: N-(4-acetylphenyl)-N-(1,3-benzothiazol-2-yl)-4-(phenylthio)butyramide Formula: C25H22N2O2S2 MolecularWeight: 446.58438

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)N(C2=NC3=CC=CC=C3S2)C(=O)CCCSC4=CC=CC=C4

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)N(C2=NC3=CC=CC=C3S2)C(=O)CCCSC4=CC=CC=C4

InChI

InChI=1S/C25H22N2O2S2/c1-18(28)19-13-15-20(16-14-19)27(25-26-22-10-5-6-11-23(22)31-25)24(29)12-7-17-30-21-8-3-2-4-9-21/h2-6,8-11,13-16H,7,12,17H2,1H3