N-(1,3-benzothiazol-2-yl)-4-(2-bromanyl-4-chloranyl-3,5-dimethyl-phenoxy)butanamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-4-(2-bromanyl-4-chloranyl-3,5-dimethyl-phenoxy)butanamide Openeye Name: N-(1,3-benzothiazol-2-yl)-4-(2-bromo-4-chloro-3,5-dimethyl-phenoxy)butanamide CAS Name: N-(1,3-benzothiazol-2-yl)-4-(2-bromo-4-chloro-3,5-dimethylphenoxy)butanamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-4-(2-bromo-4-chloro-3,5-dimethylphenoxy)butanamide Traditional Name: N-(1,3-benzothiazol-2-yl)-4-(2-bromo-4-chloro-3,5-dimethyl-phenoxy)butyramide Formula: C19H18BrClN2O2S MolecularWeight: 453.78042

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1Cl)C)Br)OCCCC(=O)NC2=NC3=CC=CC=C3S2

Isomeric SMILES

CC1=CC(=C(C(=C1Cl)C)Br)OCCCC(=O)NC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C19H18BrClN2O2S/c1-11-10-14(17(20)12(2)18(11)21)25-9-5-8-16(24)23-19-22-13-6-3-4-7-15(13)26-19/h3-4,6-7,10H,5,8-9H2,1-2H3,(H,22,23,24)