1-(2-ethylphenyl)-3-[2-[(4-methylphenyl)sulfonylamino]-1,3-benzothiazol-5-yl]urea

Systemtic Name: 1-(2-ethylphenyl)-3-[2-[(4-methylphenyl)sulfonylamino]-1,3-benzothiazol-5-yl]urea Openeye Name: 1-(2-ethylphenyl)-3-[2-(p-tolylsulfonylamino)-1,3-benzothiazol-5-yl]urea CAS Name: 1-(2-ethylphenyl)-3-[2-[(4-methylphenyl)sulfonylamino]-1,3-benzothiazol-5-yl]urea IUPAC Name: 1-(2-ethylphenyl)-3-[2-[(4-methylphenyl)sulfonylamino]-1,3-benzothiazol-5-yl]urea Traditional Name: 1-(2-ethylphenyl)-3-[2-(tosylamino)-1,3-benzothiazol-5-yl]urea Formula: C23H22N4O3S2 MolecularWeight: 466.57578

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)NC2=CC3=C(C=C2)SC(=N3)NS(=O)(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)NC2=CC3=C(C=C2)SC(=N3)NS(=O)(=O)C4=CC=C(C=C4)C

InChI

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