N-[2-(azepan-1-yl)-5-morpholin-4-ylsulfonyl-phenyl]-5-methyl-pyrazine-2-carboxamide

Systemtic Name: N-[2-(azepan-1-yl)-5-morpholin-4-ylsulfonyl-phenyl]-5-methyl-pyrazine-2-carboxamide Openeye Name: N-[2-(azepan-1-yl)-5-morpholinosulfonyl-phenyl]-5-methyl-pyrazine-2-carboxamide CAS Name: N-[2-(1-azepanyl)-5-(4-morpholinylsulfonyl)phenyl]-5-methyl-2-pyrazinecarboxamide IUPAC Name: N-[2-(azepan-1-yl)-5-morpholin-4-ylsulfonylphenyl]-5-methylpyrazine-2-carboxamide Traditional Name: N-[2-(azepan-1-yl)-5-morpholinosulfonyl-phenyl]-5-methyl-pyrazinamide Formula: C22H29N5O4S MolecularWeight: 459.56176

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(N=C1)C(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)N4CCCCCC4

Isomeric SMILES

CC1=NC=C(N=C1)C(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)N4CCCCCC4

InChI

InChI=1S/C22H29N5O4S/c1-17-15-24-20(16-23-17)22(28)25-19-14-18(32(29,30)27-10-12-31-13-11-27)6-7-21(19)26-8-4-2-3-5-9-26/h6-7,14-16H,2-5,8-13H2,1H3,(H,25,28)