N-(6-methyl-1,3-benzothiazol-2-yl)-2-[(2-methylphenyl)-methylsulfonyl-amino]-N-(phenylmethyl)ethanamide

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)N(CC3=CC=CC=C3)C(=O)CN(C4=CC=CC=C4C)S(=O)(=O)C

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)N(CC3=CC=CC=C3)C(=O)CN(C4=CC=CC=C4C)S(=O)(=O)C

InChI

InChI=1S/C25H25N3O3S2/c1-18-13-14-21-23(15-18)32-25(26-21)27(16-20-10-5-4-6-11-20)24(29)17-28(33(3,30)31)22-12-8-7-9-19(22)2/h4-15H,16-17H2,1-3H3