N-[(5-methylthiophen-2-yl)methyl]-2,3-bis(oxidanylidene)-N-phenethyl-1,4-dihydroquinoxaline-6-sulfonamide

Systemtic Name: N-[(5-methylthiophen-2-yl)methyl]-2,3-bis(oxidanylidene)-N-phenethyl-1,4-dihydroquinoxaline-6-sulfonamide Openeye Name: N-[(5-methyl-2-thienyl)methyl]-2,3-dioxo-N-phenethyl-1,4-dihydroquinoxaline-6-sulfonamide CAS Name: N-[(5-methyl-2-thiophenyl)methyl]-2,3-dioxo-N-phenethyl-1,4-dihydroquinoxaline-6-sulfonamide IUPAC Name: N-[(5-methylthiophen-2-yl)methyl]-2,3-dioxo-N-phenethyl-1,4-dihydroquinoxaline-6-sulfonamide Traditional Name: 2,3-diketo-N-[(5-methyl-2-thienyl)methyl]-N-phenethyl-1,4-dihydroquinoxaline-6-sulfonamide Formula: C22H21N3O4S2 MolecularWeight: 455.54984

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)CN(CCC2=CC=CC=C2)S(=O)(=O)C3=CC4=C(C=C3)NC(=O)C(=O)N4

Isomeric SMILES

CC1=CC=C(S1)CN(CCC2=CC=CC=C2)S(=O)(=O)C3=CC4=C(C=C3)NC(=O)C(=O)N4

InChI

InChI=1S/C22H21N3O4S2/c1-15-7-8-17(30-15)14-25(12-11-16-5-3-2-4-6-16)31(28,29)18-9-10-19-20(13-18)24-22(27)21(26)23-19/h2-10,13H,11-12,14H2,1H3,(H,23,26)(H,24,27)