1-(4-sulfanylphenyl)-3-[[3-[[(4-sulfanylphenyl)carbamoylamino]methyl]cyclohexyl]methyl]urea

Systemtic Name: 1-(4-sulfanylphenyl)-3-[[3-[[(4-sulfanylphenyl)carbamoylamino]methyl]cyclohexyl]methyl]urea Openeye Name: 1-(4-sulfanylphenyl)-3-[[3-[[(4-sulfanylphenyl)carbamoylamino]methyl]cyclohexyl]methyl]urea CAS Name: 1-[[3-[[[(4-mercaptoanilino)-oxomethyl]amino]methyl]cyclohexyl]methyl]-3-(4-mercaptophenyl)urea IUPAC Name: 1-(4-sulfanylphenyl)-3-[[3-[[(4-sulfanylphenyl)carbamoylamino]methyl]cyclohexyl]methyl]urea Traditional Name: 1-(4-mercaptophenyl)-3-[[3-[[(4-mercaptophenyl)carbamoylamino]methyl]cyclohexyl]methyl]urea Formula: C22H28N4O2S2 MolecularWeight: 444.61332

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CC(C1)CNC(=O)NC2=CC=C(C=C2)S)CNC(=O)NC3=CC=C(C=C3)S

Isomeric SMILES

C1CC(CC(C1)CNC(=O)NC2=CC=C(C=C2)S)CNC(=O)NC3=CC=C(C=C3)S

InChI

InChI=1S/C22H28N4O2S2/c27-21(25-17-4-8-19(29)9-5-17)23-13-15-2-1-3-16(12-15)14-24-22(28)26-18-6-10-20(30)11-7-18/h4-11,15-16,29-30H,1-3,12-14H2,(H2,23,25,27)(H2,24,26,28)