[3-[(3-chlorophenyl)sulfonylamino]quinoxalin-2-yl]-(pyridin-1-ium-2-ylmethyl)azanide

Systemtic Name: [3-[(3-chlorophenyl)sulfonylamino]quinoxalin-2-yl]-(pyridin-1-ium-2-ylmethyl)azanide Openeye Name: [3-[(3-chlorophenyl)sulfonylamino]quinoxalin-2-yl]-(pyridin-1-ium-2-ylmethyl)azanide CAS Name: [3-[(3-chlorophenyl)sulfonylamino]-2-quinoxalinyl]-(2-pyridin-1-iumylmethyl)azanide IUPAC Name: [3-[(3-chlorophenyl)sulfonylamino]quinoxalin-2-yl]-(pyridin-1-ium-2-ylmethyl)azanide Traditional Name: [3-[(3-chlorophenyl)sulfonylamino]quinoxalin-2-yl]-(pyridin-1-ium-2-ylmethyl)azanide Formula: C20H16ClN5O2S MolecularWeight: 425.89134

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(C(=N2)[N-]CC3=CC=CC=[NH+]3)NS(=O)(=O)C4=CC(=CC=C4)Cl

Isomeric SMILES

C1=CC=C2C(=C1)N=C(C(=N2)[N-]CC3=CC=CC=[NH+]3)NS(=O)(=O)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C20H15ClN5O2S/c21-14-6-5-8-16(12-14)29(27,28)26-20-19(23-13-15-7-3-4-11-22-15)24-17-9-1-2-10-18(17)25-20/h1-12H,13H2,(H-,23,24,25,26)/q-1/p+1