3-[3-(1,3-benzothiazol-2-yl)-4-[(4-methylphenyl)sulfonylamino]phenyl]-1,1-dimethyl-urea

Systemtic Name: 3-[3-(1,3-benzothiazol-2-yl)-4-[(4-methylphenyl)sulfonylamino]phenyl]-1,1-dimethyl-urea Openeye Name: 3-[3-(1,3-benzothiazol-2-yl)-4-(p-tolylsulfonylamino)phenyl]-1,1-dimethyl-urea CAS Name: 3-[3-(1,3-benzothiazol-2-yl)-4-[(4-methylphenyl)sulfonylamino]phenyl]-1,1-dimethylurea IUPAC Name: 3-[3-(1,3-benzothiazol-2-yl)-4-[(4-methylphenyl)sulfonylamino]phenyl]-1,1-dimethylurea Traditional Name: 3-[3-(1,3-benzothiazol-2-yl)-4-(tosylamino)phenyl]-1,1-dimethyl-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=C(C=C(C=C2)NC(=O)N(C)C)C3=NC4=CC=CC=C4S3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=C(C=C(C=C2)NC(=O)N(C)C)C3=NC4=CC=CC=C4S3

InChI

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