3-bromanyl-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-4-(2-methylpropoxy)benzamide

Systemtic Name: 3-bromanyl-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-4-(2-methylpropoxy)benzamide Openeye Name: 3-bromo-4-isobutoxy-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]benzamide CAS Name: 3-bromo-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-4-(2-methylpropoxy)benzamide IUPAC Name: 3-bromo-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-4-(2-methylpropoxy)benzamide Traditional Name: 3-bromo-4-isobutoxy-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]benzamide 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)C4=CC(=C(C=C4)OCC(C)C)Br

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC(=O)C4=CC(=C(C=C4)OCC(C)C)Br

InChI

InChI=1S/C25H23BrN2O2S/c1-15(2)14-30-22-11-7-18(13-20(22)26)24(29)27-19-8-5-17(6-9-19)25-28-21-10-4-16(3)12-23(21)31-25/h4-13,15H,14H2,1-3H3,(H,27,29)