3-(4-chloranyl-2-methyl-phenyl)-1-heptyl-1-[(4-propan-2-ylphenyl)methyl]urea

Systemtic Name: 3-(4-chloranyl-2-methyl-phenyl)-1-heptyl-1-[(4-propan-2-ylphenyl)methyl]urea Openeye Name: 3-(4-chloro-2-methyl-phenyl)-1-heptyl-1-[(4-isopropylphenyl)methyl]urea CAS Name: 3-(4-chloro-2-methylphenyl)-1-heptyl-1-[(4-propan-2-ylphenyl)methyl]urea IUPAC Name: 3-(4-chloro-2-methylphenyl)-1-heptyl-1-[(4-propan-2-ylphenyl)methyl]urea Traditional Name: 3-(4-chloro-2-methyl-phenyl)-1-heptyl-1-(4-isopropylbenzyl)urea Formula: C25H35ClN2O MolecularWeight: 415.0112

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCN(CC1=CC=C(C=C1)C(C)C)C(=O)NC2=C(C=C(C=C2)Cl)C

Isomeric SMILES

CCCCCCCN(CC1=CC=C(C=C1)C(C)C)C(=O)NC2=C(C=C(C=C2)Cl)C

InChI

InChI=1S/C25H35ClN2O/c1-5-6-7-8-9-16-28(18-21-10-12-22(13-11-21)19(2)3)25(29)27-24-15-14-23(26)17-20(24)4/h10-15,17,19H,5-9,16,18H2,1-4H3,(H,27,29)