1-[4-methyl-2-[(4-methylphenyl)sulfonylamino]-1,3-benzothiazol-6-yl]-3-(2-methylphenyl)urea

Systemtic Name: 1-[4-methyl-2-[(4-methylphenyl)sulfonylamino]-1,3-benzothiazol-6-yl]-3-(2-methylphenyl)urea Openeye Name: 1-[4-methyl-2-(p-tolylsulfonylamino)-1,3-benzothiazol-6-yl]-3-(o-tolyl)urea CAS Name: 1-[4-methyl-2-[(4-methylphenyl)sulfonylamino]-1,3-benzothiazol-6-yl]-3-(2-methylphenyl)urea IUPAC Name: 1-[4-methyl-2-[(4-methylphenyl)sulfonylamino]-1,3-benzothiazol-6-yl]-3-(2-methylphenyl)urea Traditional Name: 1-[4-methyl-2-(tosylamino)-1,3-benzothiazol-6-yl]-3-(o-tolyl)urea Formula: C23H22N4O3S2 MolecularWeight: 466.57578

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=NC3=C(S2)C=C(C=C3C)NC(=O)NC4=CC=CC=C4C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=NC3=C(S2)C=C(C=C3C)NC(=O)NC4=CC=CC=C4C

InChI

InChI=1S/C23H22N4O3S2/c1-14-8-10-18(11-9-14)32(29,30)27-23-26-21-16(3)12-17(13-20(21)31-23)24-22(28)25-19-7-5-4-6-15(19)2/h4-13H,1-3H3,(H,26,27)(H2,24,25,28)