1-[4-methyl-3-[2-[[2-methyl-5-(octadecylcarbamoylamino)phenyl]carbamoylamino]ethylcarbamoylamino]phenyl]-3-octadecyl-urea

Systemtic Name: 1-[4-methyl-3-[2-[[2-methyl-5-(octadecylcarbamoylamino)phenyl]carbamoylamino]ethylcarbamoylamino]phenyl]-3-octadecyl-urea Openeye Name: 1-[4-methyl-3-[2-[[2-methyl-5-(octadecylcarbamoylamino)phenyl]carbamoylamino]ethylcarbamoylamino]phenyl]-3-octadecyl-urea CAS Name: 1-[4-methyl-3-[[[2-[[[2-methyl-5-[[(octadecylamino)-oxomethyl]amino]anilino]-oxomethyl]amino]ethylamino]-oxomethyl]amino]phenyl]-3-octadecylurea IUPAC Name: 1-[4-methyl-3-[2-[[2-methyl-5-(octadecylcarbamoylamino)phenyl]carbamoylamino]ethylcarbamoylamino]phenyl]-3-octadecylurea Traditional Name: 1-[4-methyl-3-[2-[[2-methyl-5-(stearylcarbamoylamino)phenyl]carbamoylamino]ethylcarbamoylamino]phenyl]-3-stearyl-urea Formula: C56H98N8O4 MolecularWeight: 947.42852

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCNC(=O)NC1=CC(=C(C=C1)C)NC(=O)NCCNC(=O)NC2=C(C=CC(=C2)NC(=O)NCCCCCCCCCCCCCCCCCC)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCNC(=O)NC1=CC(=C(C=C1)C)NC(=O)NCCNC(=O)NC2=C(C=CC(=C2)NC(=O)NCCCCCCCCCCCCCCCCCC)C

InChI

InChI=1S/C56H98N8O4/c1-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-41-57-53(65)61-49-39-37-47(3)51(45-49)63-55(67)59-43-44-60-56(68)64-52-46-50(40-38-48(52)4)62-54(66)58-42-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-2/h37-40,45-46H,5-36,41-44H2,1-4H3,(H2,57,61,65)(H2,58,62,66)(H2,59,63,67)(H2,60,64,68)