1-methyl-1-[1-(4-methylsulfonylphenyl)ethyl]-3-(4-phenylbutyl)urea

Systemtic Name: 1-methyl-1-[1-(4-methylsulfonylphenyl)ethyl]-3-(4-phenylbutyl)urea Openeye Name: 1-methyl-1-[1-(4-methylsulfonylphenyl)ethyl]-3-(4-phenylbutyl)urea CAS Name: 1-methyl-1-[1-(4-methylsulfonylphenyl)ethyl]-3-(4-phenylbutyl)urea IUPAC Name: 1-methyl-1-[1-(4-methylsulfonylphenyl)ethyl]-3-(4-phenylbutyl)urea Traditional Name: 1-[1-(4-mesylphenyl)ethyl]-1-methyl-3-(4-phenylbutyl)urea Formula: C21H28N2O3S MolecularWeight: 388.52362

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)S(=O)(=O)C)N(C)C(=O)NCCCCC2=CC=CC=C2

Isomeric SMILES

CC(C1=CC=C(C=C1)S(=O)(=O)C)N(C)C(=O)NCCCCC2=CC=CC=C2

InChI

InChI=1S/C21H28N2O3S/c1-17(19-12-14-20(15-13-19)27(3,25)26)23(2)21(24)22-16-8-7-11-18-9-5-4-6-10-18/h4-6,9-10,12-15,17H,7-8,11,16H2,1-3H3,(H,22,24)