methyl 4-(naphthalen-2-ylsulfonylmethyl)-5-oxidanylidene-5-[(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)-pentyl-amino]pentanoate

Systemtic Name: methyl 4-(naphthalen-2-ylsulfonylmethyl)-5-oxidanylidene-5-[(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)-pentyl-amino]pentanoate Openeye Name: methyl 4-(2-naphthylsulfonylmethyl)-5-oxo-5-[(2-oxo-2-pyrrolidin-1-yl-ethyl)-pentyl-amino]pentanoate CAS Name: 4-(2-naphthalenylsulfonylmethyl)-5-oxo-5-[[2-oxo-2-(1-pyrrolidinyl)ethyl]-pentylamino]pentanoic acid methyl ester IUPAC Name: methyl 4-(naphthalen-2-ylsulfonylmethyl)-5-oxo-5-[(2-oxo-2-pyrrolidin-1-ylethyl)-pentylamino]pentanoate Traditional Name: 5-[amyl-(2-keto-2-pyrrolidino-ethyl)amino]-5-keto-4-(2-naphthylsulfonylmethyl)valeric acid methyl ester Formula: C28H38N2O6S MolecularWeight: 530.67612

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(CC(=O)N1CCCC1)C(=O)C(CCC(=O)OC)CS(=O)(=O)C2=CC3=CC=CC=C3C=C2

Isomeric SMILES

CCCCCN(CC(=O)N1CCCC1)C(=O)C(CCC(=O)OC)CS(=O)(=O)C2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C28H38N2O6S/c1-3-4-7-18-30(20-26(31)29-16-8-9-17-29)28(33)24(13-15-27(32)36-2)21-37(34,35)25-14-12-22-10-5-6-11-23(22)19-25/h5-6,10-12,14,19,24H,3-4,7-9,13,15-18,20-21H2,1-2H3