1-(2,5-dimethylphenyl)-3-[2-[(4-fluorophenyl)sulfonylamino]phenyl]thiourea

Systemtic Name: 1-(2,5-dimethylphenyl)-3-[2-[(4-fluorophenyl)sulfonylamino]phenyl]thiourea Openeye Name: 1-(2,5-dimethylphenyl)-3-[2-[(4-fluorophenyl)sulfonylamino]phenyl]thiourea CAS Name: 1-(2,5-dimethylphenyl)-3-[2-[(4-fluorophenyl)sulfonylamino]phenyl]thiourea IUPAC Name: 1-(2,5-dimethylphenyl)-3-[2-[(4-fluorophenyl)sulfonylamino]phenyl]thiourea Traditional Name: 1-(2,5-dimethylphenyl)-3-[2-[(4-fluorophenyl)sulfonylamino]phenyl]thiourea Formula: C21H20FN3O2S2 MolecularWeight: 429.530803

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=S)NC2=CC=CC=C2NS(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=S)NC2=CC=CC=C2NS(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C21H20FN3O2S2/c1-14-7-8-15(2)20(13-14)24-21(28)23-18-5-3-4-6-19(18)25-29(26,27)17-11-9-16(22)10-12-17/h3-13,25H,1-2H3,(H2,23,24,28)