N-[4-(1-benzofuran-2-yl)-1,3-thiazol-2-yl]-4-(4-methylphenyl)sulfanyl-butanamide

Systemtic Name: N-[4-(1-benzofuran-2-yl)-1,3-thiazol-2-yl]-4-(4-methylphenyl)sulfanyl-butanamide Openeye Name: N-[4-(benzofuran-2-yl)thiazol-2-yl]-4-(p-tolylsulfanyl)butanamide CAS Name: N-[4-(2-benzofuranyl)-2-thiazolyl]-4-[(4-methylphenyl)thio]butanamide IUPAC Name: N-[4-(1-benzofuran-2-yl)-1,3-thiazol-2-yl]-4-(4-methylphenyl)sulfanylbutanamide Traditional Name: N-[4-(benzofuran-2-yl)thiazol-2-yl]-4-(p-tolylthio)butyramide Formula: C22H20N2O2S2 MolecularWeight: 408.5364

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCCC(=O)NC2=NC(=CS2)C3=CC4=CC=CC=C4O3

Isomeric SMILES

CC1=CC=C(C=C1)SCCCC(=O)NC2=NC(=CS2)C3=CC4=CC=CC=C4O3

InChI

InChI=1S/C22H20N2O2S2/c1-15-8-10-17(11-9-15)27-12-4-7-21(25)24-22-23-18(14-28-22)20-13-16-5-2-3-6-19(16)26-20/h2-3,5-6,8-11,13-14H,4,7,12H2,1H3,(H,23,24,25)