(4-acetamidophenyl)sulfonyl-[3-[4-(4-dimethylaminophenyl)pyridin-1-ium-1-yl]quinoxalin-2-yl]azanide

Systemtic Name: (4-acetamidophenyl)sulfonyl-[3-[4-(4-dimethylaminophenyl)pyridin-1-ium-1-yl]quinoxalin-2-yl]azanide Openeye Name: (4-acetamidophenyl)sulfonyl-[3-[4-(4-dimethylaminophenyl)pyridin-1-ium-1-yl]quinoxalin-2-yl]azanide CAS Name: (4-acetamidophenyl)sulfonyl-[3-[4-(4-dimethylaminophenyl)-1-pyridin-1-iumyl]-2-quinoxalinyl]azanide IUPAC Name: (4-acetamidophenyl)sulfonyl-[3-[4-(4-dimethylaminophenyl)pyridin-1-ium-1-yl]quinoxalin-2-yl]azanide Traditional Name: (4-acetamidophenyl)sulfonyl-[3-[4-(4-dimethylaminophenyl)pyridin-1-ium-1-yl]quinoxalin-2-yl]azanide Formula: C29H26N6O3S MolecularWeight: 538.62014

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)[N-]C2=NC3=CC=CC=C3N=C2[N+]4=CC=C(C=C4)C5=CC=C(C=C5)N(C)C

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)[N-]C2=NC3=CC=CC=C3N=C2[N+]4=CC=C(C=C4)C5=CC=C(C=C5)N(C)C

InChI

InChI=1S/C29H26N6O3S/c1-20(36)30-23-10-14-25(15-11-23)39(37,38)33-28-29(32-27-7-5-4-6-26(27)31-28)35-18-16-22(17-19-35)21-8-12-24(13-9-21)34(2)3/h4-19H,1-3H3,(H-,30,31,33,36)