4-(4-methylpiperidin-1-yl)sulfonyl-2-nitro-N-(3-pyrazin-2-yloxyphenyl)aniline

Systemtic Name: 4-(4-methylpiperidin-1-yl)sulfonyl-2-nitro-N-(3-pyrazin-2-yloxyphenyl)aniline Openeye Name: 4-[(4-methyl-1-piperidyl)sulfonyl]-2-nitro-N-(3-pyrazin-2-yloxyphenyl)aniline CAS Name: 4-[(4-methyl-1-piperidinyl)sulfonyl]-2-nitro-N-[3-(2-pyrazinyloxy)phenyl]aniline IUPAC Name: 4-(4-methylpiperidin-1-yl)sulfonyl-2-nitro-N-(3-pyrazin-2-yloxyphenyl)aniline Traditional Name: [4-(4-methylpiperidino)sulfonyl-2-nitro-phenyl]-(3-pyrazin-2-yloxyphenyl)amine Formula: C22H23N5O5S MolecularWeight: 469.51352

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)NC3=CC(=CC=C3)OC4=NC=CN=C4)[N+](=O)[O-]

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)NC3=CC(=CC=C3)OC4=NC=CN=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H23N5O5S/c1-16-7-11-26(12-8-16)33(30,31)19-5-6-20(21(14-19)27(28)29)25-17-3-2-4-18(13-17)32-22-15-23-9-10-24-22/h2-6,9-10,13-16,25H,7-8,11-12H2,1H3