1-(3-ethylphenyl)-3-[4-[methyl-[2-[(4-sulfamoylphenyl)amino]pyrimidin-4-yl]amino]phenyl]urea

Systemtic Name: 1-(3-ethylphenyl)-3-[4-[methyl-[2-[(4-sulfamoylphenyl)amino]pyrimidin-4-yl]amino]phenyl]urea Openeye Name: 1-(3-ethylphenyl)-3-[4-[methyl-[2-(4-sulfamoylanilino)pyrimidin-4-yl]amino]phenyl]urea CAS Name: 1-(3-ethylphenyl)-3-[4-[methyl-[2-(4-sulfamoylanilino)-4-pyrimidinyl]amino]phenyl]urea IUPAC Name: 1-(3-ethylphenyl)-3-[4-[methyl-[2-(4-sulfamoylanilino)pyrimidin-4-yl]amino]phenyl]urea Traditional Name: 1-(3-ethylphenyl)-3-[4-[methyl-[2-(4-sulfamoylanilino)pyrimidin-4-yl]amino]phenyl]urea Formula: C26H27N7O3S MolecularWeight: 517.60268

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)NC(=O)NC2=CC=C(C=C2)N(C)C3=NC(=NC=C3)NC4=CC=C(C=C4)S(=O)(=O)N

Isomeric SMILES

CCC1=CC(=CC=C1)NC(=O)NC2=CC=C(C=C2)N(C)C3=NC(=NC=C3)NC4=CC=C(C=C4)S(=O)(=O)N

InChI

InChI=1S/C26H27N7O3S/c1-3-18-5-4-6-21(17-18)31-26(34)30-20-7-11-22(12-8-20)33(2)24-15-16-28-25(32-24)29-19-9-13-23(14-10-19)37(27,35)36/h4-17H,3H2,1-2H3,(H2,27,35,36)(H,28,29,32)(H2,30,31,34)