1-[(4-butylphenyl)methyl]-3-(4-chloranyl-2-methyl-phenyl)-1-(phenylmethyl)urea

Systemtic Name: 1-[(4-butylphenyl)methyl]-3-(4-chloranyl-2-methyl-phenyl)-1-(phenylmethyl)urea Openeye Name: 1-benzyl-1-[(4-butylphenyl)methyl]-3-(4-chloro-2-methyl-phenyl)urea CAS Name: 1-[(4-butylphenyl)methyl]-3-(4-chloro-2-methylphenyl)-1-(phenylmethyl)urea IUPAC Name: 1-benzyl-1-[(4-butylphenyl)methyl]-3-(4-chloro-2-methylphenyl)urea Traditional Name: 1-benzyl-1-(4-butylbenzyl)-3-(4-chloro-2-methyl-phenyl)urea Formula: C26H29ClN2O MolecularWeight: 420.97426

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)CN(CC2=CC=CC=C2)C(=O)NC3=C(C=C(C=C3)Cl)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)CN(CC2=CC=CC=C2)C(=O)NC3=C(C=C(C=C3)Cl)C

InChI

InChI=1S/C26H29ClN2O/c1-3-4-8-21-11-13-23(14-12-21)19-29(18-22-9-6-5-7-10-22)26(30)28-25-16-15-24(27)17-20(25)2/h5-7,9-17H,3-4,8,18-19H2,1-2H3,(H,28,30)