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

Systemtic Name: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-2-[(4-methylphenyl)sulfonyl-phenyl-amino]ethanamide Openeye Name: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-2-[N-(p-tolylsulfonyl)anilino]acetamide CAS Name: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-2-(N-(4-methylphenyl)sulfonylanilino)acetamide IUPAC Name: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-2-(N-(4-methylphenyl)sulfonylanilino)acetamide Traditional Name: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-2-(N-tosylanilino)acetamide Formula: C29H25N3O3S2 MolecularWeight: 527.6571

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NC2=CC=C(C=C2)C3=NC4=C(S3)C=C(C=C4)C)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NC2=CC=C(C=C2)C3=NC4=C(S3)C=C(C=C4)C)C5=CC=CC=C5

InChI

InChI=1S/C29H25N3O3S2/c1-20-8-15-25(16-9-20)37(34,35)32(24-6-4-3-5-7-24)19-28(33)30-23-13-11-22(12-14-23)29-31-26-17-10-21(2)18-27(26)36-29/h3-18H,19H2,1-2H3,(H,30,33)