N-[4-(4-cyanophenyl)-1,3-thiazol-2-yl]-4-(2,6-dipyrrolidin-1-ylpyrimidin-4-yl)piperazine-1-carboxamide

Systemtic Name: N-[4-(4-cyanophenyl)-1,3-thiazol-2-yl]-4-(2,6-dipyrrolidin-1-ylpyrimidin-4-yl)piperazine-1-carboxamide Openeye Name: N-[4-(4-cyanophenyl)thiazol-2-yl]-4-(2,6-dipyrrolidin-1-ylpyrimidin-4-yl)piperazine-1-carboxamide CAS Name: 4-[2,6-bis(1-pyrrolidinyl)-4-pyrimidinyl]-N-[4-(4-cyanophenyl)-2-thiazolyl]-1-piperazinecarboxamide IUPAC Name: N-[4-(4-cyanophenyl)-1,3-thiazol-2-yl]-4-(2,6-dipyrrolidin-1-ylpyrimidin-4-yl)piperazine-1-carboxamide Traditional Name: N-[4-(4-cyanophenyl)thiazol-2-yl]-4-(2,6-dipyrrolidinopyrimidin-4-yl)piperazine-1-carboxamide Formula: C27H31N9OS MolecularWeight: 529.65974

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=CC(=NC(=N2)N3CCCC3)N4CCN(CC4)C(=O)NC5=NC(=CS5)C6=CC=C(C=C6)C#N

Isomeric SMILES

C1CCN(C1)C2=CC(=NC(=N2)N3CCCC3)N4CCN(CC4)C(=O)NC5=NC(=CS5)C6=CC=C(C=C6)C#N

InChI

InChI=1S/C27H31N9OS/c28-18-20-5-7-21(8-6-20)22-19-38-26(29-22)32-27(37)36-15-13-34(14-16-36)24-17-23(33-9-1-2-10-33)30-25(31-24)35-11-3-4-12-35/h5-8,17,19H,1-4,9-16H2,(H,29,32,37)