1-heptyl-3-thiophen-2-ylsulfonyl-pyrrolo[3,2-b]quinoxalin-2-amine

Systemtic Name: 1-heptyl-3-thiophen-2-ylsulfonyl-pyrrolo[3,2-b]quinoxalin-2-amine Openeye Name: 1-heptyl-3-(2-thienylsulfonyl)pyrrolo[3,2-b]quinoxalin-2-amine CAS Name: 1-heptyl-3-thiophen-2-ylsulfonyl-2-pyrrolo[3,2-b]quinoxalinamine IUPAC Name: 1-heptyl-3-thiophen-2-ylsulfonylpyrrolo[3,2-b]quinoxalin-2-amine Traditional Name: [1-heptyl-3-(2-thienylsulfonyl)pyrrolo[3,2-b]quinoxalin-2-yl]amine Formula: C21H24N4O2S2 MolecularWeight: 428.57086

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCN1C(=C(C2=NC3=CC=CC=C3N=C21)S(=O)(=O)C4=CC=CS4)N

Isomeric SMILES

CCCCCCCN1C(=C(C2=NC3=CC=CC=C3N=C21)S(=O)(=O)C4=CC=CS4)N

InChI

InChI=1S/C21H24N4O2S2/c1-2-3-4-5-8-13-25-20(22)19(29(26,27)17-12-9-14-28-17)18-21(25)24-16-11-7-6-10-15(16)23-18/h6-7,9-12,14H,2-5,8,13,22H2,1H3