1-(2-methylphenyl)-3-[3-(4-methylphenyl)sulfonylpropanoylamino]thiourea

Systemtic Name: 1-(2-methylphenyl)-3-[3-(4-methylphenyl)sulfonylpropanoylamino]thiourea Openeye Name: 1-(o-tolyl)-3-[3-(p-tolylsulfonyl)propanoylamino]thiourea CAS Name: 1-(2-methylphenyl)-3-[[3-(4-methylphenyl)sulfonyl-1-oxopropyl]amino]thiourea IUPAC Name: 1-(2-methylphenyl)-3-[3-(4-methylphenyl)sulfonylpropanoylamino]thiourea Traditional Name: 1-(o-tolyl)-3-(3-tosylpropanoylamino)thiourea Formula: C18H21N3O3S2 MolecularWeight: 391.50764

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CCC(=O)NNC(=S)NC2=CC=CC=C2C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CCC(=O)NNC(=S)NC2=CC=CC=C2C

InChI

InChI=1S/C18H21N3O3S2/c1-13-7-9-15(10-8-13)26(23,24)12-11-17(22)20-21-18(25)19-16-6-4-3-5-14(16)2/h3-10H,11-12H2,1-2H3,(H,20,22)(H2,19,21,25)