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

Systemtic Name: 2-(pyrrolidin-1-ylmethylamino)-N-[3-[(5-thiophen-3-ylpyrimidin-2-yl)amino]phenyl]ethanamide Openeye Name: 2-(pyrrolidin-1-ylmethylamino)-N-[3-[[5-(3-thienyl)pyrimidin-2-yl]amino]phenyl]acetamide CAS Name: 2-(1-pyrrolidinylmethylamino)-N-[3-[[5-(3-thiophenyl)-2-pyrimidinyl]amino]phenyl]acetamide IUPAC Name: 2-(pyrrolidin-1-ylmethylamino)-N-[3-[(5-thiophen-3-ylpyrimidin-2-yl)amino]phenyl]acetamide Traditional Name: 2-(pyrrolidinomethylamino)-N-[3-[[5-(3-thienyl)pyrimidin-2-yl]amino]phenyl]acetamide Formula: C21H24N6OS MolecularWeight: 408.51986

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CNCC(=O)NC2=CC=CC(=C2)NC3=NC=C(C=N3)C4=CSC=C4

Isomeric SMILES

C1CCN(C1)CNCC(=O)NC2=CC=CC(=C2)NC3=NC=C(C=N3)C4=CSC=C4

InChI

InChI=1S/C21H24N6OS/c28-20(13-22-15-27-7-1-2-8-27)25-18-4-3-5-19(10-18)26-21-23-11-17(12-24-21)16-6-9-29-14-16/h3-6,9-12,14,22H,1-2,7-8,13,15H2,(H,25,28)(H,23,24,26)