2-[(5-isoquinolin-6-ylpyridin-3-yl)-naphthalen-2-ylsulfonyl-amino]ethylcarbamic acid

Systemtic Name: 2-[(5-isoquinolin-6-ylpyridin-3-yl)-naphthalen-2-ylsulfonyl-amino]ethylcarbamic acid Openeye Name: 2-[[5-(6-isoquinolyl)-3-pyridyl]-(2-naphthylsulfonyl)amino]ethylcarbamic acid CAS Name: 2-[[5-(6-isoquinolinyl)-3-pyridinyl]-(2-naphthalenylsulfonyl)amino]ethylcarbamic acid IUPAC Name: 2-[(5-isoquinolin-6-ylpyridin-3-yl)-naphthalen-2-ylsulfonylamino]ethylcarbamic acid Traditional Name: 2-[[5-(6-isoquinolyl)-3-pyridyl]-(2-naphthylsulfonyl)amino]ethylcarbamic acid Formula: C27H22N4O4S MolecularWeight: 498.55298

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)S(=O)(=O)N(CCNC(=O)O)C3=CN=CC(=C3)C4=CC5=C(C=C4)C=NC=C5

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)S(=O)(=O)N(CCNC(=O)O)C3=CN=CC(=C3)C4=CC5=C(C=C4)C=NC=C5

InChI

InChI=1S/C27H22N4O4S/c32-27(33)30-11-12-31(36(34,35)26-8-7-19-3-1-2-4-20(19)15-26)25-14-24(17-29-18-25)21-5-6-23-16-28-10-9-22(23)13-21/h1-10,13-18,30H,11-12H2,(H,32,33)