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

Systemtic Name: N-[3-[[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]amino]quinoxalin-2-yl]thiophene-2-sulfonamide Openeye Name: N-[3-[4-(6-methyl-1,3-benzothiazol-2-yl)anilino]quinoxalin-2-yl]thiophene-2-sulfonamide CAS Name: N-[3-[4-(6-methyl-1,3-benzothiazol-2-yl)anilino]-2-quinoxalinyl]-2-thiophenesulfonamide IUPAC Name: N-[3-[4-(6-methyl-1,3-benzothiazol-2-yl)anilino]quinoxalin-2-yl]thiophene-2-sulfonamide Traditional Name: N-[3-[4-(6-methyl-1,3-benzothiazol-2-yl)anilino]quinoxalin-2-yl]thiophene-2-sulfonamide Formula: C26H19N5O2S3 MolecularWeight: 529.65636

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC4=NC5=CC=CC=C5N=C4NS(=O)(=O)C6=CC=CS6

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC4=NC5=CC=CC=C5N=C4NS(=O)(=O)C6=CC=CS6

InChI

InChI=1S/C26H19N5O2S3/c1-16-8-13-21-22(15-16)35-26(30-21)17-9-11-18(12-10-17)27-24-25(29-20-6-3-2-5-19(20)28-24)31-36(32,33)23-7-4-14-34-23/h2-15H,1H3,(H,27,28)(H,29,31)