1-[(4-tert-butylphenyl)methyl]-3-[(4-methylphenyl)sulfonylmethyl]-1-(phenylmethyl)urea

Systemtic Name: 1-[(4-tert-butylphenyl)methyl]-3-[(4-methylphenyl)sulfonylmethyl]-1-(phenylmethyl)urea Openeye Name: 1-benzyl-1-[(4-tert-butylphenyl)methyl]-3-(p-tolylsulfonylmethyl)urea CAS Name: 1-[(4-tert-butylphenyl)methyl]-3-[(4-methylphenyl)sulfonylmethyl]-1-(phenylmethyl)urea IUPAC Name: 1-benzyl-1-[(4-tert-butylphenyl)methyl]-3-[(4-methylphenyl)sulfonylmethyl]urea Traditional Name: 1-benzyl-1-(4-tert-butylbenzyl)-3-(tosylmethyl)urea Formula: C27H32N2O3S MolecularWeight: 464.61958

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CNC(=O)N(CC2=CC=CC=C2)CC3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CNC(=O)N(CC2=CC=CC=C2)CC3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C27H32N2O3S/c1-21-10-16-25(17-11-21)33(31,32)20-28-26(30)29(18-22-8-6-5-7-9-22)19-23-12-14-24(15-13-23)27(2,3)4/h5-17H,18-20H2,1-4H3,(H,28,30)