1-[(E)-(4-methoxyphenyl)methylideneamino]-3-[3-(4-methylphenyl)-1-adamantyl]urea

Systemtic Name: 1-[(E)-(4-methoxyphenyl)methylideneamino]-3-[3-(4-methylphenyl)-1-adamantyl]urea Openeye Name: 1-[(E)-(4-methoxyphenyl)methyleneamino]-3-[3-(p-tolyl)-1-adamantyl]urea CAS Name: 1-[(E)-(4-methoxyphenyl)methylideneamino]-3-[3-(4-methylphenyl)-1-adamantyl]urea IUPAC Name: 1-[(E)-(4-methoxyphenyl)methylideneamino]-3-[3-(4-methylphenyl)-1-adamantyl]urea Traditional Name: 1-[(E)-p-anisylideneamino]-3-[3-(p-tolyl)-1-adamantyl]urea Formula: C26H31N3O2 MolecularWeight: 417.54324

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C23CC4CC(C2)CC(C4)(C3)NC(=O)NN=CC5=CC=C(C=C5)OC

Isomeric SMILES

CC1=CC=C(C=C1)C23CC4CC(C2)CC(C4)(C3)NC(=O)N/N=C/C5=CC=C(C=C5)OC

InChI

InChI=1S/C26H31N3O2/c1-18-3-7-22(8-4-18)25-12-20-11-21(13-25)15-26(14-20,17-25)28-24(30)29-27-16-19-5-9-23(31-2)10-6-19/h3-10,16,20-21H,11-15,17H2,1-2H3,(H2,28,29,30)/b27-16+