2-[(4-bromophenyl)-methylsulfonyl-amino]-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]ethanamide

Systemtic Name: 2-[(4-bromophenyl)-methylsulfonyl-amino]-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]ethanamide Openeye Name: 2-(4-bromo-N-methylsulfonyl-anilino)-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]acetamide CAS Name: 2-(4-bromo-N-methylsulfonylanilino)-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]acetamide IUPAC Name: 2-(4-bromo-N-methylsulfonylanilino)-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]acetamide Traditional Name: 2-(4-bromo-N-mesyl-anilino)-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]acetamide Formula: C23H20BrN3O3S2 MolecularWeight: 530.4572

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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)CN(C4=CC=C(C=C4)Br)S(=O)(=O)C

Isomeric SMILES

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

InChI

InChI=1S/C23H20BrN3O3S2/c1-15-3-12-20-21(13-15)31-23(26-20)16-4-8-18(9-5-16)25-22(28)14-27(32(2,29)30)19-10-6-17(24)7-11-19/h3-13H,14H2,1-2H3,(H,25,28)