1-[2-(cyclohexen-1-yl)ethyl]-3-(3-methylphenyl)sulfonyl-pyrrolo[3,2-b]quinoxalin-2-amine

Systemtic Name: 1-[2-(cyclohexen-1-yl)ethyl]-3-(3-methylphenyl)sulfonyl-pyrrolo[3,2-b]quinoxalin-2-amine Openeye Name: 1-[2-(cyclohexen-1-yl)ethyl]-3-(m-tolylsulfonyl)pyrrolo[3,2-b]quinoxalin-2-amine CAS Name: 1-[2-(1-cyclohexenyl)ethyl]-3-(3-methylphenyl)sulfonyl-2-pyrrolo[3,2-b]quinoxalinamine IUPAC Name: 1-[2-(cyclohexen-1-yl)ethyl]-3-(3-methylphenyl)sulfonylpyrrolo[3,2-b]quinoxalin-2-amine Traditional Name: [1-[2-(cyclohexen-1-yl)ethyl]-3-(m-tolylsulfonyl)pyrrolo[3,2-b]quinoxalin-2-yl]amine Formula: C25H26N4O2S MolecularWeight: 446.56454

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)S(=O)(=O)C2=C(N(C3=NC4=CC=CC=C4N=C23)CCC5=CCCCC5)N

Isomeric SMILES

CC1=CC(=CC=C1)S(=O)(=O)C2=C(N(C3=NC4=CC=CC=C4N=C23)CCC5=CCCCC5)N

InChI

InChI=1S/C25H26N4O2S/c1-17-8-7-11-19(16-17)32(30,31)23-22-25(28-21-13-6-5-12-20(21)27-22)29(24(23)26)15-14-18-9-3-2-4-10-18/h5-9,11-13,16H,2-4,10,14-15,26H2,1H3