1-[(4-fluorophenyl)methyl]-3-[4-[(4-methylphenyl)sulfonylamino]phenyl]thiourea

Systemtic Name: 1-[(4-fluorophenyl)methyl]-3-[4-[(4-methylphenyl)sulfonylamino]phenyl]thiourea Openeye Name: 1-[(4-fluorophenyl)methyl]-3-[4-(p-tolylsulfonylamino)phenyl]thiourea CAS Name: 1-[(4-fluorophenyl)methyl]-3-[4-[(4-methylphenyl)sulfonylamino]phenyl]thiourea IUPAC Name: 1-[(4-fluorophenyl)methyl]-3-[4-[(4-methylphenyl)sulfonylamino]phenyl]thiourea Traditional Name: 1-(4-fluorobenzyl)-3-[4-(tosylamino)phenyl]thiourea Formula: C21H20FN3O2S2 MolecularWeight: 429.530803

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)NC(=S)NCC3=CC=C(C=C3)F

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)NC(=S)NCC3=CC=C(C=C3)F

InChI

InChI=1S/C21H20FN3O2S2/c1-15-2-12-20(13-3-15)29(26,27)25-19-10-8-18(9-11-19)24-21(28)23-14-16-4-6-17(22)7-5-16/h2-13,25H,14H2,1H3,(H2,23,24,28)