3-(4-chlorophenyl)sulfonyl-1-(3-methylbutyl)pyrrolo[3,2-b]quinoxalin-2-amine

Systemtic Name: 3-(4-chlorophenyl)sulfonyl-1-(3-methylbutyl)pyrrolo[3,2-b]quinoxalin-2-amine Openeye Name: 3-(4-chlorophenyl)sulfonyl-1-isopentyl-pyrrolo[3,2-b]quinoxalin-2-amine CAS Name: 3-(4-chlorophenyl)sulfonyl-1-(3-methylbutyl)-2-pyrrolo[3,2-b]quinoxalinamine IUPAC Name: 3-(4-chlorophenyl)sulfonyl-1-(3-methylbutyl)pyrrolo[3,2-b]quinoxalin-2-amine Traditional Name: [3-(4-chlorophenyl)sulfonyl-1-isoamyl-pyrrolo[3,2-b]quinoxalin-2-yl]amine Formula: C21H21ClN4O2S MolecularWeight: 428.93504

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C(=C(C2=NC3=CC=CC=C3N=C21)S(=O)(=O)C4=CC=C(C=C4)Cl)N

Isomeric SMILES

CC(C)CCN1C(=C(C2=NC3=CC=CC=C3N=C21)S(=O)(=O)C4=CC=C(C=C4)Cl)N

InChI

InChI=1S/C21H21ClN4O2S/c1-13(2)11-12-26-20(23)19(29(27,28)15-9-7-14(22)8-10-15)18-21(26)25-17-6-4-3-5-16(17)24-18/h3-10,13H,11-12,23H2,1-2H3