3-[2-azanyl-3-(4-methylphenyl)sulfonyl-pyrrolo[3,2-b]quinoxalin-1-yl]propan-1-ol

Systemtic Name: 3-[2-azanyl-3-(4-methylphenyl)sulfonyl-pyrrolo[3,2-b]quinoxalin-1-yl]propan-1-ol Openeye Name: 3-[2-amino-3-(p-tolylsulfonyl)pyrrolo[3,2-b]quinoxalin-1-yl]propan-1-ol CAS Name: 3-[2-amino-3-(4-methylphenyl)sulfonyl-1-pyrrolo[3,2-b]quinoxalinyl]-1-propanol IUPAC Name: 3-[2-amino-3-(4-methylphenyl)sulfonylpyrrolo[3,2-b]quinoxalin-1-yl]propan-1-ol Traditional Name: 3-(2-amino-3-tosyl-pyrrolo[3,2-b]quinoxalin-1-yl)propan-1-ol Formula: C20H20N4O3S MolecularWeight: 396.4628

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2=C(N(C3=NC4=CC=CC=C4N=C23)CCCO)N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2=C(N(C3=NC4=CC=CC=C4N=C23)CCCO)N

InChI

InChI=1S/C20H20N4O3S/c1-13-7-9-14(10-8-13)28(26,27)18-17-20(24(19(18)21)11-4-12-25)23-16-6-3-2-5-15(16)22-17/h2-3,5-10,25H,4,11-12,21H2,1H3