ethyl 2-[2-[isoquinolin-5-ylsulfonyl(propyl)amino]ethanoylamino]ethanoate

Systemtic Name: ethyl 2-[2-[isoquinolin-5-ylsulfonyl(propyl)amino]ethanoylamino]ethanoate Openeye Name: ethyl 2-[[2-[5-isoquinolylsulfonyl(propyl)amino]acetyl]amino]acetate CAS Name: 2-[[2-[5-isoquinolinylsulfonyl(propyl)amino]-1-oxoethyl]amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[[2-[isoquinolin-5-ylsulfonyl(propyl)amino]acetyl]amino]acetate Traditional Name: 2-[[2-[5-isoquinolylsulfonyl(propyl)amino]acetyl]amino]acetic acid ethyl ester Formula: C18H23N3O5S MolecularWeight: 393.45732

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC(=O)NCC(=O)OCC)S(=O)(=O)C1=CC=CC2=C1C=CN=C2

Isomeric SMILES

CCCN(CC(=O)NCC(=O)OCC)S(=O)(=O)C1=CC=CC2=C1C=CN=C2

InChI

InChI=1S/C18H23N3O5S/c1-3-10-21(13-17(22)20-12-18(23)26-4-2)27(24,25)16-7-5-6-14-11-19-9-8-15(14)16/h5-9,11H,3-4,10,12-13H2,1-2H3,(H,20,22)