3-[2,5-bis(chloranyl)phenyl]sulfonyl-1-butyl-pyrrolo[3,2-b]quinoxalin-2-amine

Systemtic Name: 3-[2,5-bis(chloranyl)phenyl]sulfonyl-1-butyl-pyrrolo[3,2-b]quinoxalin-2-amine Openeye Name: 1-butyl-3-(2,5-dichlorophenyl)sulfonyl-pyrrolo[3,2-b]quinoxalin-2-amine CAS Name: 1-butyl-3-(2,5-dichlorophenyl)sulfonyl-2-pyrrolo[3,2-b]quinoxalinamine IUPAC Name: 1-butyl-3-(2,5-dichlorophenyl)sulfonylpyrrolo[3,2-b]quinoxalin-2-amine Traditional Name: [1-butyl-3-(2,5-dichlorophenyl)sulfonyl-pyrrolo[3,2-b]quinoxalin-2-yl]amine Formula: C20H18Cl2N4O2S MolecularWeight: 449.35352

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C2=NC3=CC=CC=C3N=C21)S(=O)(=O)C4=C(C=CC(=C4)Cl)Cl)N

Isomeric SMILES

CCCCN1C(=C(C2=NC3=CC=CC=C3N=C21)S(=O)(=O)C4=C(C=CC(=C4)Cl)Cl)N

InChI

InChI=1S/C20H18Cl2N4O2S/c1-2-3-10-26-19(23)18(29(27,28)16-11-12(21)8-9-13(16)22)17-20(26)25-15-7-5-4-6-14(15)24-17/h4-9,11H,2-3,10,23H2,1H3