1-(4-methoxyphenyl)-3-[9,10,16-tris(oxidanyl)hexadecanoylamino]thiourea

Systemtic Name: 1-(4-methoxyphenyl)-3-[9,10,16-tris(oxidanyl)hexadecanoylamino]thiourea Openeye Name: 1-(4-methoxyphenyl)-3-(9,10,16-trihydroxyhexadecanoylamino)thiourea CAS Name: 1-(4-methoxyphenyl)-3-[(9,10,16-trihydroxy-1-oxohexadecyl)amino]thiourea IUPAC Name: 1-(4-methoxyphenyl)-3-(9,10,16-trihydroxyhexadecanoylamino)thiourea Traditional Name: 1-(4-methoxyphenyl)-3-(9,10,16-trihydroxyhexadecanoylamino)thiourea Formula: C24H41N3O5S MolecularWeight: 483.66444

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=S)NNC(=O)CCCCCCCC(C(CCCCCCO)O)O

Isomeric SMILES

COC1=CC=C(C=C1)NC(=S)NNC(=O)CCCCCCCC(C(CCCCCCO)O)O

InChI

InChI=1S/C24H41N3O5S/c1-32-20-16-14-19(15-17-20)25-24(33)27-26-23(31)13-9-4-2-3-7-11-21(29)22(30)12-8-5-6-10-18-28/h14-17,21-22,28-30H,2-13,18H2,1H3,(H,26,31)(H2,25,27,33)