N-[3-(1,3-benzothiazol-2-yl)phenyl]-4-(4-methylphenyl)sulfanyl-butanamide

Systemtic Name: N-[3-(1,3-benzothiazol-2-yl)phenyl]-4-(4-methylphenyl)sulfanyl-butanamide Openeye Name: N-[3-(1,3-benzothiazol-2-yl)phenyl]-4-(p-tolylsulfanyl)butanamide CAS Name: N-[3-(1,3-benzothiazol-2-yl)phenyl]-4-[(4-methylphenyl)thio]butanamide IUPAC Name: N-[3-(1,3-benzothiazol-2-yl)phenyl]-4-(4-methylphenyl)sulfanylbutanamide Traditional Name: N-[3-(1,3-benzothiazol-2-yl)phenyl]-4-(p-tolylthio)butyramide Formula: C24H22N2OS2 MolecularWeight: 418.57428

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCCC(=O)NC2=CC=CC(=C2)C3=NC4=CC=CC=C4S3

Isomeric SMILES

CC1=CC=C(C=C1)SCCCC(=O)NC2=CC=CC(=C2)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C24H22N2OS2/c1-17-11-13-20(14-12-17)28-15-5-10-23(27)25-19-7-4-6-18(16-19)24-26-21-8-2-3-9-22(21)29-24/h2-4,6-9,11-14,16H,5,10,15H2,1H3,(H,25,27)