N-[2-(diethylamino)-5-piperidin-1-ylsulfonyl-phenyl]-5-methyl-pyrazine-2-carboxamide

Systemtic Name: N-[2-(diethylamino)-5-piperidin-1-ylsulfonyl-phenyl]-5-methyl-pyrazine-2-carboxamide Openeye Name: N-[2-(diethylamino)-5-(1-piperidylsulfonyl)phenyl]-5-methyl-pyrazine-2-carboxamide CAS Name: N-[2-(diethylamino)-5-(1-piperidinylsulfonyl)phenyl]-5-methyl-2-pyrazinecarboxamide IUPAC Name: N-[2-(diethylamino)-5-piperidin-1-ylsulfonylphenyl]-5-methylpyrazine-2-carboxamide Traditional Name: N-[2-(diethylamino)-5-piperidinosulfonyl-phenyl]-5-methyl-pyrazinamide Formula: C21H29N5O3S MolecularWeight: 431.55166

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)C3=CN=C(C=N3)C

Isomeric SMILES

CCN(CC)C1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)C3=CN=C(C=N3)C

InChI

InChI=1S/C21H29N5O3S/c1-4-25(5-2)20-10-9-17(30(28,29)26-11-7-6-8-12-26)13-18(20)24-21(27)19-15-22-16(3)14-23-19/h9-10,13-15H,4-8,11-12H2,1-3H3,(H,24,27)