1-(2-ethyl-6-methyl-phenyl)-3-[3-(4-methylphenyl)sulfonylpropanoylamino]thiourea

Systemtic Name: 1-(2-ethyl-6-methyl-phenyl)-3-[3-(4-methylphenyl)sulfonylpropanoylamino]thiourea Openeye Name: 1-(2-ethyl-6-methyl-phenyl)-3-[3-(p-tolylsulfonyl)propanoylamino]thiourea CAS Name: 1-(2-ethyl-6-methylphenyl)-3-[[3-(4-methylphenyl)sulfonyl-1-oxopropyl]amino]thiourea IUPAC Name: 1-(2-ethyl-6-methylphenyl)-3-[3-(4-methylphenyl)sulfonylpropanoylamino]thiourea Traditional Name: 1-(2-ethyl-6-methyl-phenyl)-3-(3-tosylpropanoylamino)thiourea Formula: C20H25N3O3S2 MolecularWeight: 419.5608

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=S)NNC(=O)CCS(=O)(=O)C2=CC=C(C=C2)C)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=S)NNC(=O)CCS(=O)(=O)C2=CC=C(C=C2)C)C

InChI

InChI=1S/C20H25N3O3S2/c1-4-16-7-5-6-15(3)19(16)21-20(27)23-22-18(24)12-13-28(25,26)17-10-8-14(2)9-11-17/h5-11H,4,12-13H2,1-3H3,(H,22,24)(H2,21,23,27)