2-(4-oxidanylpiperidin-1-yl)-N-[4-[(5-thiophen-3-ylpyrimidin-2-yl)amino]phenyl]ethanamide

Systemtic Name: 2-(4-oxidanylpiperidin-1-yl)-N-[4-[(5-thiophen-3-ylpyrimidin-2-yl)amino]phenyl]ethanamide Openeye Name: 2-(4-hydroxy-1-piperidyl)-N-[4-[[5-(3-thienyl)pyrimidin-2-yl]amino]phenyl]acetamide CAS Name: 2-(4-hydroxy-1-piperidinyl)-N-[4-[[5-(3-thiophenyl)-2-pyrimidinyl]amino]phenyl]acetamide IUPAC Name: 2-(4-hydroxypiperidin-1-yl)-N-[4-[(5-thiophen-3-ylpyrimidin-2-yl)amino]phenyl]acetamide Traditional Name: 2-(4-hydroxypiperidino)-N-[4-[[5-(3-thienyl)pyrimidin-2-yl]amino]phenyl]acetamide Formula: C21H23N5O2S MolecularWeight: 409.50462

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1O)CC(=O)NC2=CC=C(C=C2)NC3=NC=C(C=N3)C4=CSC=C4

Isomeric SMILES

C1CN(CCC1O)CC(=O)NC2=CC=C(C=C2)NC3=NC=C(C=N3)C4=CSC=C4

InChI

InChI=1S/C21H23N5O2S/c27-19-5-8-26(9-6-19)13-20(28)24-17-1-3-18(4-2-17)25-21-22-11-16(12-23-21)15-7-10-29-14-15/h1-4,7,10-12,14,19,27H,5-6,8-9,13H2,(H,24,28)(H,22,23,25)