[3-[[2-(cyclopropylamino)-2-oxidanylidene-ethyl]-methyl-amino]quinoxalin-2-yl]-(phenylsulfonyl)azanide

Systemtic Name: [3-[[2-(cyclopropylamino)-2-oxidanylidene-ethyl]-methyl-amino]quinoxalin-2-yl]-(phenylsulfonyl)azanide Openeye Name: benzenesulfonyl-[3-[[2-(cyclopropylamino)-2-oxo-ethyl]-methyl-amino]quinoxalin-2-yl]azanide CAS Name: benzenesulfonyl-[3-[[2-(cyclopropylamino)-2-oxoethyl]-methylamino]-2-quinoxalinyl]azanide IUPAC Name: benzenesulfonyl-[3-[[2-(cyclopropylamino)-2-oxoethyl]-methylamino]quinoxalin-2-yl]azanide Traditional Name: besyl-[3-[[2-(cyclopropylamino)-2-keto-ethyl]-methyl-amino]quinoxalin-2-yl]azanide Formula: C20H20N5O3S- MolecularWeight: 410.4695

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)NC1CC1)C2=NC3=CC=CC=C3N=C2[N-]S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CN(CC(=O)NC1CC1)C2=NC3=CC=CC=C3N=C2[N-]S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C20H21N5O3S/c1-25(13-18(26)21-14-11-12-14)20-19(22-16-9-5-6-10-17(16)23-20)24-29(27,28)15-7-3-2-4-8-15/h2-10,14H,11-13H2,1H3,(H2,21,22,24,26)/p-1