N-[2-(6-piperidin-1-ylpyrimidin-4-yl)oxyethyl]-4-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[2-(6-piperidin-1-ylpyrimidin-4-yl)oxyethyl]-4-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-[2-[6-(1-piperidyl)pyrimidin-4-yl]oxyethyl]-4-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-[2-[[6-(1-piperidinyl)-4-pyrimidinyl]oxy]ethyl]-4-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-[2-(6-piperidin-1-ylpyrimidin-4-yl)oxyethyl]-4-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-[2-(6-piperidinopyrimidin-4-yl)oxyethyl]-4-pyrrolidinosulfonyl-benzamide Formula: C22H29N5O4S MolecularWeight: 459.56176

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=CC(=NC=N2)OCCNC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCC4

Isomeric SMILES

C1CCN(CC1)C2=CC(=NC=N2)OCCNC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C22H29N5O4S/c28-22(18-6-8-19(9-7-18)32(29,30)27-13-4-5-14-27)23-10-15-31-21-16-20(24-17-25-21)26-11-2-1-3-12-26/h6-9,16-17H,1-5,10-15H2,(H,23,28)