1-[2-(3-bromanyl-4-methoxy-phenyl)ethyl]-3-(4-butyl-2-methyl-phenyl)urea

Systemtic Name: 1-[2-(3-bromanyl-4-methoxy-phenyl)ethyl]-3-(4-butyl-2-methyl-phenyl)urea Openeye Name: 1-[2-(3-bromo-4-methoxy-phenyl)ethyl]-3-(4-butyl-2-methyl-phenyl)urea CAS Name: 1-[2-(3-bromo-4-methoxyphenyl)ethyl]-3-(4-butyl-2-methylphenyl)urea IUPAC Name: 1-[2-(3-bromo-4-methoxyphenyl)ethyl]-3-(4-butyl-2-methylphenyl)urea Traditional Name: 1-[2-(3-bromo-4-methoxy-phenyl)ethyl]-3-(4-butyl-2-methyl-phenyl)urea Formula: C21H27BrN2O2 MolecularWeight: 419.35528

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=C(C=C1)NC(=O)NCCC2=CC(=C(C=C2)OC)Br)C

Isomeric SMILES

CCCCC1=CC(=C(C=C1)NC(=O)NCCC2=CC(=C(C=C2)OC)Br)C

InChI

InChI=1S/C21H27BrN2O2/c1-4-5-6-16-7-9-19(15(2)13-16)24-21(25)23-12-11-17-8-10-20(26-3)18(22)14-17/h7-10,13-14H,4-6,11-12H2,1-3H3,(H2,23,24,25)