2-[(2-azanyl-3-thiophen-2-yl-propyl)amino]-5-(4-fluorophenyl)-6-pyridin-4-yl-1H-pyrimidin-4-one

Systemtic Name: 2-[(2-azanyl-3-thiophen-2-yl-propyl)amino]-5-(4-fluorophenyl)-6-pyridin-4-yl-1H-pyrimidin-4-one Openeye Name: 2-[[2-amino-3-(2-thienyl)propyl]amino]-5-(4-fluorophenyl)-6-(4-pyridyl)-1H-pyrimidin-4-one CAS Name: 2-[(2-amino-3-thiophen-2-ylpropyl)amino]-5-(4-fluorophenyl)-6-pyridin-4-yl-1H-pyrimidin-4-one IUPAC Name: 2-[(2-amino-3-thiophen-2-ylpropyl)amino]-5-(4-fluorophenyl)-6-pyridin-4-yl-1H-pyrimidin-4-one Traditional Name: 2-[[2-amino-3-(2-thienyl)propyl]amino]-5-(4-fluorophenyl)-6-(4-pyridyl)-1H-pyrimidin-4-one Formula: C22H20FN5OS MolecularWeight: 421.490503

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)CC(CNC2=NC(=O)C(=C(N2)C3=CC=NC=C3)C4=CC=C(C=C4)F)N

Isomeric SMILES

C1=CSC(=C1)CC(CNC2=NC(=O)C(=C(N2)C3=CC=NC=C3)C4=CC=C(C=C4)F)N

InChI

InChI=1S/C22H20FN5OS/c23-16-5-3-14(4-6-16)19-20(15-7-9-25-10-8-15)27-22(28-21(19)29)26-13-17(24)12-18-2-1-11-30-18/h1-11,17H,12-13,24H2,(H2,26,27,28,29)