4-(4-tert-butylphenoxy)-N-(6-chloranyl-1,3-benzothiazol-2-yl)butanamide

Systemtic Name: 4-(4-tert-butylphenoxy)-N-(6-chloranyl-1,3-benzothiazol-2-yl)butanamide Openeye Name: 4-(4-tert-butylphenoxy)-N-(6-chloro-1,3-benzothiazol-2-yl)butanamide CAS Name: 4-(4-tert-butylphenoxy)-N-(6-chloro-1,3-benzothiazol-2-yl)butanamide IUPAC Name: 4-(4-tert-butylphenoxy)-N-(6-chloro-1,3-benzothiazol-2-yl)butanamide Traditional Name: 4-(4-tert-butylphenoxy)-N-(6-chloro-1,3-benzothiazol-2-yl)butyramide Formula: C21H23ClN2O2S MolecularWeight: 402.93752

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)OCCCC(=O)NC2=NC3=C(S2)C=C(C=C3)Cl

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)OCCCC(=O)NC2=NC3=C(S2)C=C(C=C3)Cl

InChI

InChI=1S/C21H23ClN2O2S/c1-21(2,3)14-6-9-16(10-7-14)26-12-4-5-19(25)24-20-23-17-11-8-15(22)13-18(17)27-20/h6-11,13H,4-5,12H2,1-3H3,(H,23,24,25)