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

Systemtic Name: 1-[4-methyl-2-[(4-methylphenyl)sulfonylamino]-1,3-benzothiazol-6-yl]-3-(3-methylphenyl)urea Openeye Name: 1-[4-methyl-2-(p-tolylsulfonylamino)-1,3-benzothiazol-6-yl]-3-(m-tolyl)urea CAS Name: 1-[4-methyl-2-[(4-methylphenyl)sulfonylamino]-1,3-benzothiazol-6-yl]-3-(3-methylphenyl)urea IUPAC Name: 1-[4-methyl-2-[(4-methylphenyl)sulfonylamino]-1,3-benzothiazol-6-yl]-3-(3-methylphenyl)urea Traditional Name: 1-[4-methyl-2-(tosylamino)-1,3-benzothiazol-6-yl]-3-(m-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(=C4)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=NC3=C(S2)C=C(C=C3C)NC(=O)NC4=CC=CC(=C4)C

InChI

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