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

Systemtic Name: 5-bromanyl-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-2-phenethyloxy-benzamide Openeye Name: 5-bromo-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-2-phenethyloxy-benzamide CAS Name: 5-bromo-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-2-phenethyloxybenzamide IUPAC Name: 5-bromo-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-2-phenethyloxybenzamide Traditional Name: 5-bromo-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-2-phenethyloxy-benzamide Formula: C29H23BrN2O2S MolecularWeight: 543.47412

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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=C(C=CC(=C4)Br)OCCC5=CC=CC=C5

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC(=O)C4=C(C=CC(=C4)Br)OCCC5=CC=CC=C5

InChI

InChI=1S/C29H23BrN2O2S/c1-19-7-13-25-27(17-19)35-29(32-25)21-8-11-23(12-9-21)31-28(33)24-18-22(30)10-14-26(24)34-16-15-20-5-3-2-4-6-20/h2-14,17-18H,15-16H2,1H3,(H,31,33)