N-(4-methyl-3-morpholin-4-ylsulfonyl-phenyl)-1-pyrazin-2-yl-piperidine-3-carboxamide

Systemtic Name: N-(4-methyl-3-morpholin-4-ylsulfonyl-phenyl)-1-pyrazin-2-yl-piperidine-3-carboxamide Openeye Name: N-(4-methyl-3-morpholinosulfonyl-phenyl)-1-pyrazin-2-yl-piperidine-3-carboxamide CAS Name: N-[4-methyl-3-(4-morpholinylsulfonyl)phenyl]-1-(2-pyrazinyl)-3-piperidinecarboxamide IUPAC Name: N-(4-methyl-3-morpholin-4-ylsulfonylphenyl)-1-pyrazin-2-ylpiperidine-3-carboxamide Traditional Name: N-(4-methyl-3-morpholinosulfonyl-phenyl)-1-pyrazin-2-yl-nipecotamide Formula: C21H27N5O4S MolecularWeight: 445.53518

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2CCCN(C2)C3=NC=CN=C3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2CCCN(C2)C3=NC=CN=C3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C21H27N5O4S/c1-16-4-5-18(13-19(16)31(28,29)26-9-11-30-12-10-26)24-21(27)17-3-2-8-25(15-17)20-14-22-6-7-23-20/h4-7,13-14,17H,2-3,8-12,15H2,1H3,(H,24,27)