4-(1,3-benzothiazol-2-ylsulfanyl)-N-(4-tert-butylphenyl)butanamide

Systemtic Name: 4-(1,3-benzothiazol-2-ylsulfanyl)-N-(4-tert-butylphenyl)butanamide Openeye Name: 4-(1,3-benzothiazol-2-ylsulfanyl)-N-(4-tert-butylphenyl)butanamide CAS Name: 4-(1,3-benzothiazol-2-ylthio)-N-(4-tert-butylphenyl)butanamide IUPAC Name: 4-(1,3-benzothiazol-2-ylsulfanyl)-N-(4-tert-butylphenyl)butanamide Traditional Name: 4-(1,3-benzothiazol-2-ylthio)-N-(4-tert-butylphenyl)butyramide Formula: C21H24N2OS2 MolecularWeight: 384.55806

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)NC(=O)CCCSC2=NC3=CC=CC=C3S2

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)NC(=O)CCCSC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C21H24N2OS2/c1-21(2,3)15-10-12-16(13-11-15)22-19(24)9-6-14-25-20-23-17-7-4-5-8-18(17)26-20/h4-5,7-8,10-13H,6,9,14H2,1-3H3,(H,22,24)