1-(3-phenylpropyl)-3-(phenylsulfonyl)pyrrolo[3,2-b]quinoxalin-2-amine

Systemtic Name: 1-(3-phenylpropyl)-3-(phenylsulfonyl)pyrrolo[3,2-b]quinoxalin-2-amine Openeye Name: 3-(benzenesulfonyl)-1-(3-phenylpropyl)pyrrolo[3,2-b]quinoxalin-2-amine CAS Name: 3-(benzenesulfonyl)-1-(3-phenylpropyl)-2-pyrrolo[3,2-b]quinoxalinamine IUPAC Name: 3-(benzenesulfonyl)-1-(3-phenylpropyl)pyrrolo[3,2-b]quinoxalin-2-amine Traditional Name: [3-besyl-1-(3-phenylpropyl)pyrrolo[3,2-b]quinoxalin-2-yl]amine Formula: C25H22N4O2S MolecularWeight: 442.53278

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCN2C(=C(C3=NC4=CC=CC=C4N=C32)S(=O)(=O)C5=CC=CC=C5)N

Isomeric SMILES

C1=CC=C(C=C1)CCCN2C(=C(C3=NC4=CC=CC=C4N=C32)S(=O)(=O)C5=CC=CC=C5)N

InChI

InChI=1S/C25H22N4O2S/c26-24-23(32(30,31)19-13-5-2-6-14-19)22-25(28-21-16-8-7-15-20(21)27-22)29(24)17-9-12-18-10-3-1-4-11-18/h1-8,10-11,13-16H,9,12,17,26H2