1-[4-[(5-bromanyl-2-ethoxy-phenyl)sulfonylamino]phenyl]-3-(2,6-diethylphenyl)thiourea

Systemtic Name: 1-[4-[(5-bromanyl-2-ethoxy-phenyl)sulfonylamino]phenyl]-3-(2,6-diethylphenyl)thiourea Openeye Name: 1-[4-[(5-bromo-2-ethoxy-phenyl)sulfonylamino]phenyl]-3-(2,6-diethylphenyl)thiourea CAS Name: 1-[4-[(5-bromo-2-ethoxyphenyl)sulfonylamino]phenyl]-3-(2,6-diethylphenyl)thiourea IUPAC Name: 1-[4-[(5-bromo-2-ethoxyphenyl)sulfonylamino]phenyl]-3-(2,6-diethylphenyl)thiourea Traditional Name: 1-[4-[(5-bromo-2-ethoxy-phenyl)sulfonylamino]phenyl]-3-(2,6-diethylphenyl)thiourea Formula: C25H28BrN3O3S2 MolecularWeight: 562.54212

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)NC(=S)NC2=CC=C(C=C2)NS(=O)(=O)C3=C(C=CC(=C3)Br)OCC

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)NC(=S)NC2=CC=C(C=C2)NS(=O)(=O)C3=C(C=CC(=C3)Br)OCC

InChI

InChI=1S/C25H28BrN3O3S2/c1-4-17-8-7-9-18(5-2)24(17)28-25(33)27-20-11-13-21(14-12-20)29-34(30,31)23-16-19(26)10-15-22(23)32-6-3/h7-16,29H,4-6H2,1-3H3,(H2,27,28,33)