1-(4-methylphenyl)-3-(3,5,7-trimethyl-1-adamantyl)urea

Systemtic Name: 1-(4-methylphenyl)-3-(3,5,7-trimethyl-1-adamantyl)urea Openeye Name: 1-(p-tolyl)-3-(3,5,7-trimethyl-1-adamantyl)urea CAS Name: 1-(4-methylphenyl)-3-(3,5,7-trimethyl-1-adamantyl)urea IUPAC Name: 1-(4-methylphenyl)-3-(3,5,7-trimethyl-1-adamantyl)urea Traditional Name: 1-(p-tolyl)-3-(3,5,7-trimethyl-1-adamantyl)urea Formula: C21H30N2O MolecularWeight: 326.4757

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)NC23CC4(CC(C2)(CC(C4)(C3)C)C)C

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)NC23CC4(CC(C2)(CC(C4)(C3)C)C)C

InChI

InChI=1S/C21H30N2O/c1-15-5-7-16(8-6-15)22-17(24)23-21-12-18(2)9-19(3,13-21)11-20(4,10-18)14-21/h5-8H,9-14H2,1-4H3,(H2,22,23,24)