N-[4-[(2S,6S)-2,6-dimethylpiperidin-1-yl]sulfonylphenyl]pyrazine-2-carboxamide

Systemtic Name: N-[4-[(2S,6S)-2,6-dimethylpiperidin-1-yl]sulfonylphenyl]pyrazine-2-carboxamide Openeye Name: N-[4-[[(2S,6S)-2,6-dimethyl-1-piperidyl]sulfonyl]phenyl]pyrazine-2-carboxamide CAS Name: N-[4-[[(2S,6S)-2,6-dimethyl-1-piperidinyl]sulfonyl]phenyl]-2-pyrazinecarboxamide IUPAC Name: N-[4-[(2S,6S)-2,6-dimethylpiperidin-1-yl]sulfonylphenyl]pyrazine-2-carboxamide Traditional Name: N-[4-[(2S,6S)-2,6-dimethylpiperidino]sulfonylphenyl]pyrazinamide Formula: C18H22N4O3S MolecularWeight: 374.45728

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(N1S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=NC=CN=C3)C

Isomeric SMILES

C[C@H]1CCC[C@@H](N1S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=NC=CN=C3)C

InChI

InChI=1S/C18H22N4O3S/c1-13-4-3-5-14(2)22(13)26(24,25)16-8-6-15(7-9-16)21-18(23)17-12-19-10-11-20-17/h6-14H,3-5H2,1-2H3,(H,21,23)/t13-,14-/m0/s1