(aminocarbonylamino) 2-[2-(4-phenylmethoxyphenyl)ethyl]-5-(phenylmethylsulfanyl)pentanoate

Systemtic Name: (aminocarbonylamino) 2-[2-(4-phenylmethoxyphenyl)ethyl]-5-(phenylmethylsulfanyl)pentanoate Openeye Name: ureido 2-[2-(4-benzyloxyphenyl)ethyl]-5-benzylsulfanyl-pentanoate CAS Name: 2-[2-(4-phenylmethoxyphenyl)ethyl]-5-(phenylmethylthio)pentanoic acid (carbamoylamino) ester IUPAC Name: (carbamoylamino) 5-benzylsulfanyl-2-[2-(4-phenylmethoxyphenyl)ethyl]pentanoate Traditional Name: 2-[2-(4-benzoxyphenyl)ethyl]-5-(benzylthio)valeric acid ureido ester Formula: C28H32N2O4S MolecularWeight: 492.62968

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=C(C=C2)CCC(CCCSCC3=CC=CC=C3)C(=O)ONC(=O)N

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=C(C=C2)CCC(CCCSCC3=CC=CC=C3)C(=O)ONC(=O)N

InChI

InChI=1S/C28H32N2O4S/c29-28(32)30-34-27(31)25(12-7-19-35-21-24-10-5-2-6-11-24)16-13-22-14-17-26(18-15-22)33-20-23-8-3-1-4-9-23/h1-6,8-11,14-15,17-18,25H,7,12-13,16,19-21H2,(H3,29,30,32)