N-[(4-methylphenyl)methyl]-4-(5-morpholin-4-ylsulfonylpyridin-2-yl)piperazine-1-carboxamide

Systemtic Name: N-[(4-methylphenyl)methyl]-4-(5-morpholin-4-ylsulfonylpyridin-2-yl)piperazine-1-carboxamide Openeye Name: 4-(5-morpholinosulfonyl-2-pyridyl)-N-(p-tolylmethyl)piperazine-1-carboxamide CAS Name: N-[(4-methylphenyl)methyl]-4-[5-(4-morpholinylsulfonyl)-2-pyridinyl]-1-piperazinecarboxamide IUPAC Name: N-[(4-methylphenyl)methyl]-4-(5-morpholin-4-ylsulfonylpyridin-2-yl)piperazine-1-carboxamide Traditional Name: N-(4-methylbenzyl)-4-(5-morpholinosulfonyl-2-pyridyl)piperazine-1-carboxamide Formula: C22H29N5O4S MolecularWeight: 459.56176

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)N2CCN(CC2)C3=NC=C(C=C3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)N2CCN(CC2)C3=NC=C(C=C3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C22H29N5O4S/c1-18-2-4-19(5-3-18)16-24-22(28)26-10-8-25(9-11-26)21-7-6-20(17-23-21)32(29,30)27-12-14-31-15-13-27/h2-7,17H,8-16H2,1H3,(H,24,28)