2-azanyl-2-(naphthalen-1-ylmethyl)-4-oxidanylidene-3-propyl-6-pyrimidin-2-ylsulfonyl-hexanoic acid

Systemtic Name: 2-azanyl-2-(naphthalen-1-ylmethyl)-4-oxidanylidene-3-propyl-6-pyrimidin-2-ylsulfonyl-hexanoic acid Openeye Name: 2-amino-2-(1-naphthylmethyl)-4-oxo-3-propyl-6-pyrimidin-2-ylsulfonyl-hexanoic acid CAS Name: 2-amino-2-(1-naphthalenylmethyl)-4-oxo-3-propyl-6-(2-pyrimidinylsulfonyl)hexanoic acid IUPAC Name: 2-amino-2-(naphthalen-1-ylmethyl)-4-oxo-3-propyl-6-pyrimidin-2-ylsulfonylhexanoic acid Traditional Name: 2-amino-4-keto-2-(1-naphthylmethyl)-3-propyl-6-(2-pyrimidylsulfonyl)hexanoic acid Formula: C24H27N3O5S MolecularWeight: 469.55328

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)CCS(=O)(=O)C1=NC=CC=N1)C(CC2=CC=CC3=CC=CC=C32)(C(=O)O)N

Isomeric SMILES

CCCC(C(=O)CCS(=O)(=O)C1=NC=CC=N1)C(CC2=CC=CC3=CC=CC=C32)(C(=O)O)N

InChI

InChI=1S/C24H27N3O5S/c1-2-7-20(21(28)12-15-33(31,32)23-26-13-6-14-27-23)24(25,22(29)30)16-18-10-5-9-17-8-3-4-11-19(17)18/h3-6,8-11,13-14,20H,2,7,12,15-16,25H2,1H3,(H,29,30)