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

Systemtic Name: N-[4-(1,3-benzothiazol-2-yl)-1,3-thiazol-2-yl]-4-(4-methylphenyl)sulfanyl-butanamide Openeye Name: N-[4-(1,3-benzothiazol-2-yl)thiazol-2-yl]-4-(p-tolylsulfanyl)butanamide CAS Name: N-[4-(1,3-benzothiazol-2-yl)-2-thiazolyl]-4-[(4-methylphenyl)thio]butanamide IUPAC Name: N-[4-(1,3-benzothiazol-2-yl)-1,3-thiazol-2-yl]-4-(4-methylphenyl)sulfanylbutanamide Traditional Name: N-[4-(1,3-benzothiazol-2-yl)thiazol-2-yl]-4-(p-tolylthio)butyramide Formula: C21H19N3OS3 MolecularWeight: 425.59006

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCCC(=O)NC2=NC(=CS2)C3=NC4=CC=CC=C4S3

Isomeric SMILES

CC1=CC=C(C=C1)SCCCC(=O)NC2=NC(=CS2)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C21H19N3OS3/c1-14-8-10-15(11-9-14)26-12-4-7-19(25)24-21-23-17(13-27-21)20-22-16-5-2-3-6-18(16)28-20/h2-3,5-6,8-11,13H,4,7,12H2,1H3,(H,23,24,25)