1-tert-butyl-3-[9,10,16-tris(oxidanyl)hexadecanoylamino]thiourea

Systemtic Name: 1-tert-butyl-3-[9,10,16-tris(oxidanyl)hexadecanoylamino]thiourea Openeye Name: 1-tert-butyl-3-(9,10,16-trihydroxyhexadecanoylamino)thiourea CAS Name: 1-tert-butyl-3-[(9,10,16-trihydroxy-1-oxohexadecyl)amino]thiourea IUPAC Name: 1-tert-butyl-3-(9,10,16-trihydroxyhexadecanoylamino)thiourea Traditional Name: 1-tert-butyl-3-(9,10,16-trihydroxyhexadecanoylamino)thiourea Formula: C21H43N3O4S MolecularWeight: 433.64882

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=S)NNC(=O)CCCCCCCC(C(CCCCCCO)O)O

Isomeric SMILES

CC(C)(C)NC(=S)NNC(=O)CCCCCCCC(C(CCCCCCO)O)O

InChI

InChI=1S/C21H43N3O4S/c1-21(2,3)22-20(29)24-23-19(28)15-11-6-4-5-9-13-17(26)18(27)14-10-7-8-12-16-25/h17-18,25-27H,4-16H2,1-3H3,(H,23,28)(H2,22,24,29)