[3-(dimethylamino)phenyl]-[4-(6-pyrrolidin-1-ylpyrimidin-4-yl)piperazin-1-yl]methanone

Systemtic Name: [3-(dimethylamino)phenyl]-[4-(6-pyrrolidin-1-ylpyrimidin-4-yl)piperazin-1-yl]methanone Openeye Name: [3-(dimethylamino)phenyl]-[4-(6-pyrrolidin-1-ylpyrimidin-4-yl)piperazin-1-yl]methanone CAS Name: [3-(dimethylamino)phenyl]-[4-[6-(1-pyrrolidinyl)-4-pyrimidinyl]-1-piperazinyl]methanone IUPAC Name: [3-(dimethylamino)phenyl]-[4-(6-pyrrolidin-1-ylpyrimidin-4-yl)piperazin-1-yl]methanone Traditional Name: [3-(dimethylamino)phenyl]-[4-(6-pyrrolidinopyrimidin-4-yl)piperazino]methanone Formula: C21H28N6O MolecularWeight: 380.48662

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=CC(=C1)C(=O)N2CCN(CC2)C3=NC=NC(=C3)N4CCCC4

Isomeric SMILES

CN(C)C1=CC=CC(=C1)C(=O)N2CCN(CC2)C3=NC=NC(=C3)N4CCCC4

InChI

InChI=1S/C21H28N6O/c1-24(2)18-7-5-6-17(14-18)21(28)27-12-10-26(11-13-27)20-15-19(22-16-23-20)25-8-3-4-9-25/h5-7,14-16H,3-4,8-13H2,1-2H3