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

Systemtic Name: 2-[3-(pyrrolidin-1-ylmethyl)pyrrolidin-1-yl]-N-[4-[(5-thiophen-3-ylpyrimidin-2-yl)amino]phenyl]ethanamide Openeye Name: 2-[3-(pyrrolidin-1-ylmethyl)pyrrolidin-1-yl]-N-[4-[[5-(3-thienyl)pyrimidin-2-yl]amino]phenyl]acetamide CAS Name: 2-[3-(1-pyrrolidinylmethyl)-1-pyrrolidinyl]-N-[4-[[5-(3-thiophenyl)-2-pyrimidinyl]amino]phenyl]acetamide IUPAC Name: 2-[3-(pyrrolidin-1-ylmethyl)pyrrolidin-1-yl]-N-[4-[(5-thiophen-3-ylpyrimidin-2-yl)amino]phenyl]acetamide Traditional Name: 2-[3-(pyrrolidinomethyl)pyrrolidino]-N-[4-[[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)CC2CCN(C2)CC(=O)NC3=CC=C(C=C3)NC4=NC=C(C=N4)C5=CSC=C5

Isomeric SMILES

C1CCN(C1)CC2CCN(C2)CC(=O)NC3=CC=C(C=C3)NC4=NC=C(C=N4)C5=CSC=C5

InChI

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