1-(2,6-diethylphenyl)-3-[3-(2-ethylhexylcarbamoylamino)-4-methyl-phenyl]urea

Systemtic Name: 1-(2,6-diethylphenyl)-3-[3-(2-ethylhexylcarbamoylamino)-4-methyl-phenyl]urea Openeye Name: 1-(2,6-diethylphenyl)-3-[3-(2-ethylhexylcarbamoylamino)-4-methyl-phenyl]urea CAS Name: 1-[5-[[(2,6-diethylanilino)-oxomethyl]amino]-2-methylphenyl]-3-(2-ethylhexyl)urea IUPAC Name: 1-(2,6-diethylphenyl)-3-[3-(2-ethylhexylcarbamoylamino)-4-methylphenyl]urea Traditional Name: 1-(2,6-diethylphenyl)-3-[3-(2-ethylhexylcarbamoylamino)-4-methyl-phenyl]urea Formula: C27H40N4O2 MolecularWeight: 452.6321

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CNC(=O)NC1=C(C=CC(=C1)NC(=O)NC2=C(C=CC=C2CC)CC)C

Isomeric SMILES

CCCCC(CC)CNC(=O)NC1=C(C=CC(=C1)NC(=O)NC2=C(C=CC=C2CC)CC)C

InChI

InChI=1S/C27H40N4O2/c1-6-10-12-20(7-2)18-28-26(32)30-24-17-23(16-15-19(24)5)29-27(33)31-25-21(8-3)13-11-14-22(25)9-4/h11,13-17,20H,6-10,12,18H2,1-5H3,(H2,28,30,32)(H2,29,31,33)