[4-[[(phenylmethyl)-[(4-propan-2-ylphenyl)carbamoyl]amino]methyl]phenyl] methanesulfonate

Systemtic Name: [4-[[(phenylmethyl)-[(4-propan-2-ylphenyl)carbamoyl]amino]methyl]phenyl] methanesulfonate Openeye Name: [4-[[benzyl-[(4-isopropylphenyl)carbamoyl]amino]methyl]phenyl] methanesulfonate CAS Name: methanesulfonic acid [4-[[[oxo-(4-propan-2-ylanilino)methyl]-(phenylmethyl)amino]methyl]phenyl] ester IUPAC Name: [4-[[benzyl-[(4-propan-2-ylphenyl)carbamoyl]amino]methyl]phenyl] methanesulfonate Traditional Name: methanesulfonic acid [4-[[benzyl(p-cumenylcarbamoyl)amino]methyl]phenyl] ester Formula: C25H28N2O4S MolecularWeight: 452.56582

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)NC(=O)N(CC2=CC=CC=C2)CC3=CC=C(C=C3)OS(=O)(=O)C

Isomeric SMILES

CC(C)C1=CC=C(C=C1)NC(=O)N(CC2=CC=CC=C2)CC3=CC=C(C=C3)OS(=O)(=O)C

InChI

InChI=1S/C25H28N2O4S/c1-19(2)22-11-13-23(14-12-22)26-25(28)27(17-20-7-5-4-6-8-20)18-21-9-15-24(16-10-21)31-32(3,29)30/h4-16,19H,17-18H2,1-3H3,(H,26,28)