1-(4-methylsulfanylphenyl)-3-[6-[(4-methylsulfanylphenyl)carbamoylamino]hexyl]urea

Systemtic Name: 1-(4-methylsulfanylphenyl)-3-[6-[(4-methylsulfanylphenyl)carbamoylamino]hexyl]urea Openeye Name: 1-(4-methylsulfanylphenyl)-3-[6-[(4-methylsulfanylphenyl)carbamoylamino]hexyl]urea CAS Name: 1-[6-[[[4-(methylthio)anilino]-oxomethyl]amino]hexyl]-3-[4-(methylthio)phenyl]urea IUPAC Name: 1-(4-methylsulfanylphenyl)-3-[6-[(4-methylsulfanylphenyl)carbamoylamino]hexyl]urea Traditional Name: 1-[4-(methylthio)phenyl]-3-[6-[[4-(methylthio)phenyl]carbamoylamino]hexyl]urea Formula: C22H30N4O2S2 MolecularWeight: 446.6292

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)NC(=O)NCCCCCCNC(=O)NC2=CC=C(C=C2)SC

Isomeric SMILES

CSC1=CC=C(C=C1)NC(=O)NCCCCCCNC(=O)NC2=CC=C(C=C2)SC

InChI

InChI=1S/C22H30N4O2S2/c1-29-19-11-7-17(8-12-19)25-21(27)23-15-5-3-4-6-16-24-22(28)26-18-9-13-20(30-2)14-10-18/h7-14H,3-6,15-16H2,1-2H3,(H2,23,25,27)(H2,24,26,28)