1-[[3-(2-hydroxyethylsulfanyl)-1,2,4-thiadiazol-5-yl]amino]-3-(2-octyldodecyl)urea

Systemtic Name: 1-[[3-(2-hydroxyethylsulfanyl)-1,2,4-thiadiazol-5-yl]amino]-3-(2-octyldodecyl)urea Openeye Name: 1-[[3-(2-hydroxyethylsulfanyl)-1,2,4-thiadiazol-5-yl]amino]-3-(2-octyldodecyl)urea CAS Name: 1-[[3-(2-hydroxyethylthio)-1,2,4-thiadiazol-5-yl]amino]-3-(2-octyldodecyl)urea IUPAC Name: 1-[[3-(2-hydroxyethylsulfanyl)-1,2,4-thiadiazol-5-yl]amino]-3-(2-octyldodecyl)urea Traditional Name: 1-[[3-(2-hydroxyethylthio)-1,2,4-thiadiazol-5-yl]amino]-3-(2-octyldodecyl)urea Formula: C25H49N5O2S2 MolecularWeight: 515.81886

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC(CCCCCCCC)CNC(=O)NNC1=NC(=NS1)SCCO

Isomeric SMILES

CCCCCCCCCCC(CCCCCCCC)CNC(=O)NNC1=NC(=NS1)SCCO

InChI

InChI=1S/C25H49N5O2S2/c1-3-5-7-9-11-12-14-16-18-22(17-15-13-10-8-6-4-2)21-26-23(32)28-29-24-27-25(30-34-24)33-20-19-31/h22,31H,3-21H2,1-2H3,(H2,26,28,32)(H,27,29,30)