N-methyl-5-[3-[(5-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)amino]propoxy]pyridine-3-carboxamide

Systemtic Name: N-methyl-5-[3-[(5-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)amino]propoxy]pyridine-3-carboxamide Openeye Name: N-methyl-5-[3-[[5-(2-pyridyl)thieno[2,3-d]pyrimidin-4-yl]amino]propoxy]pyridine-3-carboxamide CAS Name: N-methyl-5-[3-[[5-(2-pyridinyl)-4-thieno[2,3-d]pyrimidinyl]amino]propoxy]-3-pyridinecarboxamide IUPAC Name: N-methyl-5-[3-[(5-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)amino]propoxy]pyridine-3-carboxamide Traditional Name: N-methyl-5-[3-[[5-(2-pyridyl)thieno[2,3-d]pyrimidin-4-yl]amino]propoxy]nicotinamide Formula: C21H20N6O2S MolecularWeight: 420.4875

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CC(=CN=C1)OCCCNC2=C3C(=CSC3=NC=N2)C4=CC=CC=N4

Isomeric SMILES

CNC(=O)C1=CC(=CN=C1)OCCCNC2=C3C(=CSC3=NC=N2)C4=CC=CC=N4

InChI

InChI=1S/C21H20N6O2S/c1-22-20(28)14-9-15(11-23-10-14)29-8-4-7-25-19-18-16(17-5-2-3-6-24-17)12-30-21(18)27-13-26-19/h2-3,5-6,9-13H,4,7-8H2,1H3,(H,22,28)(H,25,26,27)