N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-2-[phenylsulfonyl-(4-propan-2-ylphenyl)amino]ethanamide

Systemtic Name: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-2-[phenylsulfonyl-(4-propan-2-ylphenyl)amino]ethanamide Openeye Name: 2-[N-(benzenesulfonyl)-4-isopropyl-anilino]-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]acetamide CAS Name: 2-[N-(benzenesulfonyl)-4-propan-2-ylanilino]-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]acetamide IUPAC Name: 2-[N-(benzenesulfonyl)-4-propan-2-ylanilino]-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]acetamide Traditional Name: 2-(N-besyl-4-isopropyl-anilino)-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]acetamide Formula: C31H29N3O3S2 MolecularWeight: 555.71026

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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)C(C)C)S(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC(=O)CN(C4=CC=C(C=C4)C(C)C)S(=O)(=O)C5=CC=CC=C5

InChI

InChI=1S/C31H29N3O3S2/c1-21(2)23-12-16-26(17-13-23)34(39(36,37)27-7-5-4-6-8-27)20-30(35)32-25-14-10-24(11-15-25)31-33-28-18-9-22(3)19-29(28)38-31/h4-19,21H,20H2,1-3H3,(H,32,35)