2-(4-bromanyl-2,6-dimethyl-phenoxy)-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]propanamide

Systemtic Name: 2-(4-bromanyl-2,6-dimethyl-phenoxy)-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]propanamide Openeye Name: 2-(4-bromo-2,6-dimethyl-phenoxy)-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]propanamide CAS Name: 2-(4-bromo-2,6-dimethylphenoxy)-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]propanamide IUPAC Name: 2-(4-bromo-2,6-dimethylphenoxy)-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]propanamide Traditional Name: 2-(4-bromo-2,6-dimethyl-phenoxy)-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]propionamide Formula: C25H23BrN2O2S MolecularWeight: 495.43132

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC(=O)C(C)OC4=C(C=C(C=C4C)Br)C

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC(=O)C(C)OC4=C(C=C(C=C4C)Br)C

InChI

InChI=1S/C25H23BrN2O2S/c1-14-5-10-21-22(11-14)31-25(28-21)18-6-8-20(9-7-18)27-24(29)17(4)30-23-15(2)12-19(26)13-16(23)3/h5-13,17H,1-4H3,(H,27,29)