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

Systemtic Name: 4-piperidin-1-ylsulfonyl-N-[2-(6-pyrrolidin-1-ylpyrimidin-4-yl)oxyethyl]benzamide Openeye Name: 4-(1-piperidylsulfonyl)-N-[2-(6-pyrrolidin-1-ylpyrimidin-4-yl)oxyethyl]benzamide CAS Name: 4-(1-piperidinylsulfonyl)-N-[2-[[6-(1-pyrrolidinyl)-4-pyrimidinyl]oxy]ethyl]benzamide IUPAC Name: 4-piperidin-1-ylsulfonyl-N-[2-(6-pyrrolidin-1-ylpyrimidin-4-yl)oxyethyl]benzamide Traditional Name: 4-piperidinosulfonyl-N-[2-(6-pyrrolidinopyrimidin-4-yl)oxyethyl]benzamide Formula: C22H29N5O4S MolecularWeight: 459.56176

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NCCOC3=NC=NC(=C3)N4CCCC4

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NCCOC3=NC=NC(=C3)N4CCCC4

InChI

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