4-(naphthalen-2-ylsulfonylmethyl)-5-oxidanylidene-5-[[2-oxidanylidene-2-(propan-2-ylamino)ethyl]-pentyl-amino]pentanoic acid

Systemtic Name: 4-(naphthalen-2-ylsulfonylmethyl)-5-oxidanylidene-5-[[2-oxidanylidene-2-(propan-2-ylamino)ethyl]-pentyl-amino]pentanoic acid Openeye Name: 5-[[2-(isopropylamino)-2-oxo-ethyl]-pentyl-amino]-4-(2-naphthylsulfonylmethyl)-5-oxo-pentanoic acid CAS Name: 4-(2-naphthalenylsulfonylmethyl)-5-oxo-5-[[2-oxo-2-(propan-2-ylamino)ethyl]-pentylamino]pentanoic acid IUPAC Name: 4-(naphthalen-2-ylsulfonylmethyl)-5-oxo-5-[[2-oxo-2-(propan-2-ylamino)ethyl]-pentylamino]pentanoic acid Traditional Name: 5-[amyl-[2-(isopropylamino)-2-keto-ethyl]amino]-5-keto-4-(2-naphthylsulfonylmethyl)valeric acid Formula: C26H36N2O6S MolecularWeight: 504.63884

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(CC(=O)NC(C)C)C(=O)C(CCC(=O)O)CS(=O)(=O)C1=CC2=CC=CC=C2C=C1

Isomeric SMILES

CCCCCN(CC(=O)NC(C)C)C(=O)C(CCC(=O)O)CS(=O)(=O)C1=CC2=CC=CC=C2C=C1

InChI

InChI=1S/C26H36N2O6S/c1-4-5-8-15-28(17-24(29)27-19(2)3)26(32)22(12-14-25(30)31)18-35(33,34)23-13-11-20-9-6-7-10-21(20)16-23/h6-7,9-11,13,16,19,22H,4-5,8,12,14-15,17-18H2,1-3H3,(H,27,29)(H,30,31)