1-[(4-chlorophenyl)methyl]-3-(4-heptylphenyl)-1-(pyridin-3-ylmethyl)urea

Systemtic Name: 1-[(4-chlorophenyl)methyl]-3-(4-heptylphenyl)-1-(pyridin-3-ylmethyl)urea Openeye Name: 1-[(4-chlorophenyl)methyl]-3-(4-heptylphenyl)-1-(3-pyridylmethyl)urea CAS Name: 1-[(4-chlorophenyl)methyl]-3-(4-heptylphenyl)-1-(3-pyridinylmethyl)urea IUPAC Name: 1-[(4-chlorophenyl)methyl]-3-(4-heptylphenyl)-1-(pyridin-3-ylmethyl)urea Traditional Name: 1-(4-chlorobenzyl)-3-(4-heptylphenyl)-1-(3-pyridylmethyl)urea Formula: C27H32ClN3O MolecularWeight: 450.01548

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC=C(C=C1)NC(=O)N(CC2=CC=C(C=C2)Cl)CC3=CN=CC=C3

Isomeric SMILES

CCCCCCCC1=CC=C(C=C1)NC(=O)N(CC2=CC=C(C=C2)Cl)CC3=CN=CC=C3

InChI

InChI=1S/C27H32ClN3O/c1-2-3-4-5-6-8-22-12-16-26(17-13-22)30-27(32)31(21-24-9-7-18-29-19-24)20-23-10-14-25(28)15-11-23/h7,9-19H,2-6,8,20-21H2,1H3,(H,30,32)