(2S)-N-cyclopentyl-N-methyl-5-[6-(methylamino)pyridin-3-yl]-2-(naphthalen-2-ylsulfonylamino)pent-4-ynamide

Systemtic Name: (2S)-N-cyclopentyl-N-methyl-5-[6-(methylamino)pyridin-3-yl]-2-(naphthalen-2-ylsulfonylamino)pent-4-ynamide Openeye Name: (2S)-N-cyclopentyl-N-methyl-5-[6-(methylamino)-3-pyridyl]-2-(2-naphthylsulfonylamino)pent-4-ynamide CAS Name: (2S)-N-cyclopentyl-N-methyl-5-[6-(methylamino)-3-pyridinyl]-2-(2-naphthalenylsulfonylamino)-4-pentynamide IUPAC Name: (2S)-N-cyclopentyl-N-methyl-5-[6-(methylamino)pyridin-3-yl]-2-(naphthalen-2-ylsulfonylamino)pent-4-ynamide Traditional Name: (2S)-N-cyclopentyl-N-methyl-5-[6-(methylamino)-3-pyridyl]-2-(2-naphthylsulfonylamino)pent-4-ynamide Formula: C27H30N4O3S MolecularWeight: 490.6171

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=NC=C(C=C1)C#CCC(C(=O)N(C)C2CCCC2)NS(=O)(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

CNC1=NC=C(C=C1)C#CC[C@@H](C(=O)N(C)C2CCCC2)NS(=O)(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C27H30N4O3S/c1-28-26-17-14-20(19-29-26)8-7-13-25(27(32)31(2)23-11-5-6-12-23)30-35(33,34)24-16-15-21-9-3-4-10-22(21)18-24/h3-4,9-10,14-19,23,25,30H,5-6,11-13H2,1-2H3,(H,28,29)/t25-/m0/s1