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

Systemtic Name: 1-(3-chlorophenyl)-3-[4-methyl-2-[(4-methylphenyl)sulfonylamino]-1,3-benzothiazol-6-yl]urea Openeye Name: 1-(3-chlorophenyl)-3-[4-methyl-2-(p-tolylsulfonylamino)-1,3-benzothiazol-6-yl]urea CAS Name: 1-(3-chlorophenyl)-3-[4-methyl-2-[(4-methylphenyl)sulfonylamino]-1,3-benzothiazol-6-yl]urea IUPAC Name: 1-(3-chlorophenyl)-3-[4-methyl-2-[(4-methylphenyl)sulfonylamino]-1,3-benzothiazol-6-yl]urea Traditional Name: 1-(3-chlorophenyl)-3-[4-methyl-2-(tosylamino)-1,3-benzothiazol-6-yl]urea Formula: C22H19ClN4O3S2 MolecularWeight: 486.99426

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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)Cl

Isomeric SMILES

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

InChI

InChI=1S/C22H19ClN4O3S2/c1-13-6-8-18(9-7-13)32(29,30)27-22-26-20-14(2)10-17(12-19(20)31-22)25-21(28)24-16-5-3-4-15(23)11-16/h3-12H,1-2H3,(H,26,27)(H2,24,25,28)