3-azanyl-N-(2-bromophenyl)-6-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]pyrazine-2-carboxamide

Systemtic Name: 3-azanyl-N-(2-bromophenyl)-6-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]pyrazine-2-carboxamide Openeye Name: 3-amino-N-(2-bromophenyl)-6-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]pyrazine-2-carboxamide CAS Name: 3-amino-N-(2-bromophenyl)-6-[4-[(4-methyl-1-piperazinyl)sulfonyl]phenyl]-2-pyrazinecarboxamide IUPAC Name: 3-amino-N-(2-bromophenyl)-6-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]pyrazine-2-carboxamide Traditional Name: 3-amino-N-(2-bromophenyl)-6-[4-(4-methylpiperazino)sulfonylphenyl]pyrazinamide Formula: C22H23BrN6O3S MolecularWeight: 531.42542

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C3=CN=C(C(=N3)C(=O)NC4=CC=CC=C4Br)N

Isomeric SMILES

CN1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C3=CN=C(C(=N3)C(=O)NC4=CC=CC=C4Br)N

InChI

InChI=1S/C22H23BrN6O3S/c1-28-10-12-29(13-11-28)33(31,32)16-8-6-15(7-9-16)19-14-25-21(24)20(26-19)22(30)27-18-5-3-2-4-17(18)23/h2-9,14H,10-13H2,1H3,(H2,24,25)(H,27,30)