3-methyl-N-[3-[[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]amino]quinoxalin-2-yl]benzenesulfonamide

Systemtic Name: 3-methyl-N-[3-[[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]amino]quinoxalin-2-yl]benzenesulfonamide Openeye Name: 3-methyl-N-[3-[4-(6-methyl-1,3-benzothiazol-2-yl)anilino]quinoxalin-2-yl]benzenesulfonamide CAS Name: 3-methyl-N-[3-[4-(6-methyl-1,3-benzothiazol-2-yl)anilino]-2-quinoxalinyl]benzenesulfonamide IUPAC Name: 3-methyl-N-[3-[4-(6-methyl-1,3-benzothiazol-2-yl)anilino]quinoxalin-2-yl]benzenesulfonamide Traditional Name: 3-methyl-N-[3-[4-(6-methyl-1,3-benzothiazol-2-yl)anilino]quinoxalin-2-yl]benzenesulfonamide Formula: C29H23N5O2S2 MolecularWeight: 537.65522

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)S(=O)(=O)NC2=NC3=CC=CC=C3N=C2NC4=CC=C(C=C4)C5=NC6=C(S5)C=C(C=C6)C

Isomeric SMILES

CC1=CC(=CC=C1)S(=O)(=O)NC2=NC3=CC=CC=C3N=C2NC4=CC=C(C=C4)C5=NC6=C(S5)C=C(C=C6)C

InChI

InChI=1S/C29H23N5O2S2/c1-18-6-5-7-22(16-18)38(35,36)34-28-27(31-23-8-3-4-9-24(23)32-28)30-21-13-11-20(12-14-21)29-33-25-15-10-19(2)17-26(25)37-29/h3-17H,1-2H3,(H,30,31)(H,32,34)