3-azanyl-6-[3-methyl-4-(4-methylpiperazin-1-yl)sulfonyl-phenyl]-N-pyridin-3-yl-pyrazine-2-carboxamide

Systemtic Name: 3-azanyl-6-[3-methyl-4-(4-methylpiperazin-1-yl)sulfonyl-phenyl]-N-pyridin-3-yl-pyrazine-2-carboxamide Openeye Name: 3-amino-6-[3-methyl-4-(4-methylpiperazin-1-yl)sulfonyl-phenyl]-N-(3-pyridyl)pyrazine-2-carboxamide CAS Name: 3-amino-6-[3-methyl-4-[(4-methyl-1-piperazinyl)sulfonyl]phenyl]-N-(3-pyridinyl)-2-pyrazinecarboxamide IUPAC Name: 3-amino-6-[3-methyl-4-(4-methylpiperazin-1-yl)sulfonylphenyl]-N-pyridin-3-ylpyrazine-2-carboxamide Traditional Name: 3-amino-6-[3-methyl-4-(4-methylpiperazino)sulfonyl-phenyl]-N-(3-pyridyl)pyrazinamide Formula: C22H25N7O3S MolecularWeight: 467.544

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C2=CN=C(C(=N2)C(=O)NC3=CN=CC=C3)N)S(=O)(=O)N4CCN(CC4)C

Isomeric SMILES

CC1=C(C=CC(=C1)C2=CN=C(C(=N2)C(=O)NC3=CN=CC=C3)N)S(=O)(=O)N4CCN(CC4)C

InChI

InChI=1S/C22H25N7O3S/c1-15-12-16(5-6-19(15)33(31,32)29-10-8-28(2)9-11-29)18-14-25-21(23)20(27-18)22(30)26-17-4-3-7-24-13-17/h3-7,12-14H,8-11H2,1-2H3,(H2,23,25)(H,26,30)