N-[3-[(4-butan-2-ylphenyl)amino]quinoxalin-2-yl]-5-chloranyl-thiophene-2-sulfonamide

Systemtic Name: N-[3-[(4-butan-2-ylphenyl)amino]quinoxalin-2-yl]-5-chloranyl-thiophene-2-sulfonamide Openeye Name: 5-chloro-N-[3-(4-sec-butylanilino)quinoxalin-2-yl]thiophene-2-sulfonamide CAS Name: N-[3-(4-butan-2-ylanilino)-2-quinoxalinyl]-5-chloro-2-thiophenesulfonamide IUPAC Name: N-[3-(4-butan-2-ylanilino)quinoxalin-2-yl]-5-chlorothiophene-2-sulfonamide Traditional Name: 5-chloro-N-[3-(4-sec-butylanilino)quinoxalin-2-yl]thiophene-2-sulfonamide Formula: C22H21ClN4O2S2 MolecularWeight: 473.01074

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)NC2=NC3=CC=CC=C3N=C2NS(=O)(=O)C4=CC=C(S4)Cl

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)NC2=NC3=CC=CC=C3N=C2NS(=O)(=O)C4=CC=C(S4)Cl

InChI

InChI=1S/C22H21ClN4O2S2/c1-3-14(2)15-8-10-16(11-9-15)24-21-22(26-18-7-5-4-6-17(18)25-21)27-31(28,29)20-13-12-19(23)30-20/h4-14H,3H2,1-2H3,(H,24,25)(H,26,27)