4-(4-bromanylphenoxy)-N-(6-methyl-1,3-benzothiazol-2-yl)butanamide

Systemtic Name: 4-(4-bromanylphenoxy)-N-(6-methyl-1,3-benzothiazol-2-yl)butanamide Openeye Name: 4-(4-bromophenoxy)-N-(6-methyl-1,3-benzothiazol-2-yl)butanamide CAS Name: 4-(4-bromophenoxy)-N-(6-methyl-1,3-benzothiazol-2-yl)butanamide IUPAC Name: 4-(4-bromophenoxy)-N-(6-methyl-1,3-benzothiazol-2-yl)butanamide Traditional Name: 4-(4-bromophenoxy)-N-(6-methyl-1,3-benzothiazol-2-yl)butyramide Formula: C18H17BrN2O2S MolecularWeight: 405.30878

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)NC(=O)CCCOC3=CC=C(C=C3)Br

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)NC(=O)CCCOC3=CC=C(C=C3)Br

InChI

InChI=1S/C18H17BrN2O2S/c1-12-4-9-15-16(11-12)24-18(20-15)21-17(22)3-2-10-23-14-7-5-13(19)6-8-14/h4-9,11H,2-3,10H2,1H3,(H,20,21,22)