2-[(3,5-dimethylphenyl)-methylsulfonyl-amino]-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]ethanamide

Systemtic Name: 2-[(3,5-dimethylphenyl)-methylsulfonyl-amino]-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]ethanamide Openeye Name: 2-(3,5-dimethyl-N-methylsulfonyl-anilino)-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]acetamide CAS Name: 2-(3,5-dimethyl-N-methylsulfonylanilino)-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]acetamide IUPAC Name: 2-(3,5-dimethyl-N-methylsulfonylanilino)-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]acetamide Traditional Name: 2-(N-mesyl-3,5-dimethyl-anilino)-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]acetamide Formula: C25H25N3O3S2 MolecularWeight: 479.6143

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

Isomeric SMILES

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

InChI

InChI=1S/C25H25N3O3S2/c1-16-5-10-22-23(14-16)32-25(27-22)19-6-8-20(9-7-19)26-24(29)15-28(33(4,30)31)21-12-17(2)11-18(3)13-21/h5-14H,15H2,1-4H3,(H,26,29)