1-(3-chlorophenyl)-3-[(3S,5R)-3,5-dimethyl-1-adamantyl]urea

Systemtic Name: 1-(3-chlorophenyl)-3-[(3S,5R)-3,5-dimethyl-1-adamantyl]urea Openeye Name: 1-(3-chlorophenyl)-3-[(3S,5R)-3,5-dimethyl-1-adamantyl]urea CAS Name: 1-(3-chlorophenyl)-3-[(3S,5R)-3,5-dimethyl-1-adamantyl]urea IUPAC Name: 1-(3-chlorophenyl)-3-[(3S,5R)-3,5-dimethyl-1-adamantyl]urea Traditional Name: 1-(3-chlorophenyl)-3-[(3S,5R)-3,5-dimethyl-1-adamantyl]urea Formula: C19H25ClN2O MolecularWeight: 332.8676

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Descriptors Computed from Structure

Canonical SMILES:

CC12CC3CC(C1)(CC(C3)(C2)NC(=O)NC4=CC(=CC=C4)Cl)C

Isomeric SMILES

C[C@@]12CC3C[C@@](C1)(CC(C3)(C2)NC(=O)NC4=CC(=CC=C4)Cl)C

InChI

InChI=1S/C19H25ClN2O/c1-17-7-13-8-18(2,10-17)12-19(9-13,11-17)22-16(23)21-15-5-3-4-14(20)6-15/h3-6,13H,7-12H2,1-2H3,(H2,21,22,23)/t13?,17-,18+,19?