4-[3-(dimethylamino)propyl]-2-(4-methylphenyl)sulfonyl-pyrazino[2,3-b]indol-3-amine

Systemtic Name: 4-[3-(dimethylamino)propyl]-2-(4-methylphenyl)sulfonyl-pyrazino[2,3-b]indol-3-amine Openeye Name: 4-[3-(dimethylamino)propyl]-2-(p-tolylsulfonyl)pyrazino[2,3-b]indol-3-amine CAS Name: 4-[3-(dimethylamino)propyl]-2-(4-methylphenyl)sulfonyl-3-pyrazino[2,3-b]indolamine IUPAC Name: 4-[3-(dimethylamino)propyl]-2-(4-methylphenyl)sulfonylpyrazino[2,3-b]indol-3-amine Traditional Name: 3-(3-amino-2-tosyl-pyrazin[2,3-b]indol-4-yl)propyl-dimethyl-amine Formula: C22H25N5O2S MolecularWeight: 423.5312

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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=C4C3=N2)CCCN(C)C)N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2=C(N(C3=NC4=CC=CC=C4C3=N2)CCCN(C)C)N

InChI

InChI=1S/C22H25N5O2S/c1-15-9-11-16(12-10-15)30(28,29)22-20(23)27(14-6-13-26(2)3)21-19(25-22)17-7-4-5-8-18(17)24-21/h4-5,7-12H,6,13-14,23H2,1-3H3