1-(1-adamantyl)-3-[3-(1-adamantylcarbamoylamino)-4-methyl-phenyl]urea

Systemtic Name: 1-(1-adamantyl)-3-[3-(1-adamantylcarbamoylamino)-4-methyl-phenyl]urea Openeye Name: 1-(1-adamantyl)-3-[3-(1-adamantylcarbamoylamino)-4-methyl-phenyl]urea CAS Name: 1-(1-adamantyl)-3-[3-[[(1-adamantylamino)-oxomethyl]amino]-4-methylphenyl]urea IUPAC Name: 1-(1-adamantyl)-3-[3-(1-adamantylcarbamoylamino)-4-methylphenyl]urea Traditional Name: 1-(1-adamantyl)-3-[3-(1-adamantylcarbamoylamino)-4-methyl-phenyl]urea Formula: C29H40N4O2 MolecularWeight: 476.6535

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)NC23CC4CC(C2)CC(C4)C3)NC(=O)NC56CC7CC(C5)CC(C7)C6

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)NC23CC4CC(C2)CC(C4)C3)NC(=O)NC56CC7CC(C5)CC(C7)C6

InChI

InChI=1S/C29H40N4O2/c1-17-2-3-24(30-26(34)32-28-11-18-4-19(12-28)6-20(5-18)13-28)10-25(17)31-27(35)33-29-14-21-7-22(15-29)9-23(8-21)16-29/h2-3,10,18-23H,4-9,11-16H2,1H3,(H2,30,32,34)(H2,31,33,35)