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ethyl 2-ethanoyl-5-[(4-methylphenyl)sulfonyl-[3-(phenylmethoxycarbonylamino)propyl]amino]pentanoate

ethyl 2-ethanoyl-5-[(4-methylphenyl)sulfonyl-[3-(phenylmethoxycarbonylamino)propyl]amino]pentanoate

Systemtic Name:ethyl 2-ethanoyl-5-[(4-methylphenyl)sulfonyl-[3-(phenylmethoxycarbonylamino)propyl]amino]pentanoate
Openeye Name:ethyl 2-acetyl-5-[3-(benzyloxycarbonylamino)propyl-(p-tolylsulfonyl)amino]pentanoate
CAS Name:2-acetyl-5-[(4-methylphenyl)sulfonyl-[3-(phenylmethoxycarbonylamino)propyl]amino]pentanoic acid ethyl ester
IUPAC Name:ethyl 2-acetyl-5-[(4-methylphenyl)sulfonyl-[3-(phenylmethoxycarbonylamino)propyl]amino]pentanoate
Traditional Name:2-acetyl-5-[3-(benzyloxycarbonylamino)propyl-tosyl-amino]valeric acid ethyl ester
Formula: C27H36N2O7S
MolecularWeight: 532.64894
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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCCN(CCCNC(=O)OCC1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)C)C(=O)C


Isomeric SMILES

CCOC(=O)C(CCCN(CCCNC(=O)OCC1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)C)C(=O)C


InChI

InChI=1S/C27H36N2O7S/c1-4-35-26(31)25(22(3)30)12-8-18-29(37(33,34)24-15-13-21(2)14-16-24)19-9-17-28-27(32)36-20-23-10-6-5-7-11-23/h5-7,10-11,13-16,25H,4,8-9,12,17-20H2,1-3H3,(H,28,32)


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