4-(1,3-benzothiazol-2-ylsulfanyl)-N-(5-tert-butyl-2-methoxy-phenyl)butanamide

Systemtic Name: 4-(1,3-benzothiazol-2-ylsulfanyl)-N-(5-tert-butyl-2-methoxy-phenyl)butanamide Openeye Name: 4-(1,3-benzothiazol-2-ylsulfanyl)-N-(5-tert-butyl-2-methoxy-phenyl)butanamide CAS Name: 4-(1,3-benzothiazol-2-ylthio)-N-(5-tert-butyl-2-methoxyphenyl)butanamide IUPAC Name: 4-(1,3-benzothiazol-2-ylsulfanyl)-N-(5-tert-butyl-2-methoxyphenyl)butanamide Traditional Name: 4-(1,3-benzothiazol-2-ylthio)-N-(5-tert-butyl-2-methoxy-phenyl)butyramide Formula: C22H26N2O2S2 MolecularWeight: 414.58404

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H26N2O2S2/c1-22(2,3)15-11-12-18(26-4)17(14-15)23-20(25)10-7-13-27-21-24-16-8-5-6-9-19(16)28-21/h5-6,8-9,11-12,14H,7,10,13H2,1-4H3,(H,23,25)