ethyl 2-[isoquinolin-5-ylsulfonyl(pyridin-2-ylmethyl)amino]ethanoate

Systemtic Name: ethyl 2-[isoquinolin-5-ylsulfonyl(pyridin-2-ylmethyl)amino]ethanoate Openeye Name: ethyl 2-[5-isoquinolylsulfonyl(2-pyridylmethyl)amino]acetate CAS Name: 2-[5-isoquinolinylsulfonyl(2-pyridinylmethyl)amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[isoquinolin-5-ylsulfonyl(pyridin-2-ylmethyl)amino]acetate Traditional Name: 2-[5-isoquinolylsulfonyl(2-pyridylmethyl)amino]acetic acid ethyl ester Formula: C19H19N3O4S MolecularWeight: 385.43686

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN(CC1=CC=CC=N1)S(=O)(=O)C2=CC=CC3=C2C=CN=C3

Isomeric SMILES

CCOC(=O)CN(CC1=CC=CC=N1)S(=O)(=O)C2=CC=CC3=C2C=CN=C3

InChI

InChI=1S/C19H19N3O4S/c1-2-26-19(23)14-22(13-16-7-3-4-10-21-16)27(24,25)18-8-5-6-15-12-20-11-9-17(15)18/h3-12H,2,13-14H2,1H3