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

Systemtic Name: 2-[2-(pyrrolidin-1-ylmethyl)pyrrolidin-1-yl]-N-[3-[(5-thiophen-3-ylpyrimidin-2-yl)amino]phenyl]ethanamide Openeye Name: 2-[2-(pyrrolidin-1-ylmethyl)pyrrolidin-1-yl]-N-[3-[[5-(3-thienyl)pyrimidin-2-yl]amino]phenyl]acetamide CAS Name: 2-[2-(1-pyrrolidinylmethyl)-1-pyrrolidinyl]-N-[3-[[5-(3-thiophenyl)-2-pyrimidinyl]amino]phenyl]acetamide IUPAC Name: 2-[2-(pyrrolidin-1-ylmethyl)pyrrolidin-1-yl]-N-[3-[(5-thiophen-3-ylpyrimidin-2-yl)amino]phenyl]acetamide Traditional Name: 2-[2-(pyrrolidinomethyl)pyrrolidino]-N-[3-[[5-(3-thienyl)pyrimidin-2-yl]amino]phenyl]acetamide Formula: C25H30N6OS MolecularWeight: 462.6103

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC2CCCN2CC(=O)NC3=CC=CC(=C3)NC4=NC=C(C=N4)C5=CSC=C5

Isomeric SMILES

C1CCN(C1)CC2CCCN2CC(=O)NC3=CC=CC(=C3)NC4=NC=C(C=N4)C5=CSC=C5

InChI

InChI=1S/C25H30N6OS/c32-24(17-31-11-4-7-23(31)16-30-9-1-2-10-30)28-21-5-3-6-22(13-21)29-25-26-14-20(15-27-25)19-8-12-33-18-19/h3,5-6,8,12-15,18,23H,1-2,4,7,9-11,16-17H2,(H,28,32)(H,26,27,29)