2-[1,3-benzothiazol-2-yl-(3-methoxyphenyl)amino]-N-(4-bromanyl-3-methyl-phenyl)ethanamide

Systemtic Name: 2-[1,3-benzothiazol-2-yl-(3-methoxyphenyl)amino]-N-(4-bromanyl-3-methyl-phenyl)ethanamide Openeye Name: 2-[N-(1,3-benzothiazol-2-yl)-3-methoxy-anilino]-N-(4-bromo-3-methyl-phenyl)acetamide CAS Name: 2-[N-(1,3-benzothiazol-2-yl)-3-methoxyanilino]-N-(4-bromo-3-methylphenyl)acetamide IUPAC Name: 2-[N-(1,3-benzothiazol-2-yl)-3-methoxyanilino]-N-(4-bromo-3-methylphenyl)acetamide Traditional Name: 2-[N-(1,3-benzothiazol-2-yl)-3-methoxy-anilino]-N-(4-bromo-3-methyl-phenyl)acetamide Formula: C23H20BrN3O2S MolecularWeight: 482.3928

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)CN(C2=CC(=CC=C2)OC)C3=NC4=CC=CC=C4S3)Br

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)CN(C2=CC(=CC=C2)OC)C3=NC4=CC=CC=C4S3)Br

InChI

InChI=1S/C23H20BrN3O2S/c1-15-12-16(10-11-19(15)24)25-22(28)14-27(17-6-5-7-18(13-17)29-2)23-26-20-8-3-4-9-21(20)30-23/h3-13H,14H2,1-2H3,(H,25,28)