1-hexadecyl-3-[[3-(2-sulfanylethyl)-1,2,4-thiadiazol-5-yl]amino]urea

Systemtic Name: 1-hexadecyl-3-[[3-(2-sulfanylethyl)-1,2,4-thiadiazol-5-yl]amino]urea Openeye Name: 1-hexadecyl-3-[[3-(2-sulfanylethyl)-1,2,4-thiadiazol-5-yl]amino]urea CAS Name: 1-hexadecyl-3-[[3-(2-mercaptoethyl)-1,2,4-thiadiazol-5-yl]amino]urea IUPAC Name: 1-hexadecyl-3-[[3-(2-sulfanylethyl)-1,2,4-thiadiazol-5-yl]amino]urea Traditional Name: 1-cetyl-3-[[3-(2-mercaptoethyl)-1,2,4-thiadiazol-5-yl]amino]urea Formula: C21H41N5OS2 MolecularWeight: 443.71314

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCNC(=O)NNC1=NC(=NS1)CCS

Isomeric SMILES

CCCCCCCCCCCCCCCCNC(=O)NNC1=NC(=NS1)CCS

InChI

InChI=1S/C21H41N5OS2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-17-22-20(27)24-25-21-23-19(16-18-28)26-29-21/h28H,2-18H2,1H3,(H2,22,24,27)(H,23,25,26)