2-[[5-phenyl-2-(piperidin-1-ylmethyl)thieno[2,3-d]pyrimidin-4-yl]amino]butan-1-ol

Systemtic Name: 2-[[5-phenyl-2-(piperidin-1-ylmethyl)thieno[2,3-d]pyrimidin-4-yl]amino]butan-1-ol Openeye Name: 2-[[5-phenyl-2-(1-piperidylmethyl)thieno[2,3-d]pyrimidin-4-yl]amino]butan-1-ol CAS Name: 2-[[5-phenyl-2-(1-piperidinylmethyl)-4-thieno[2,3-d]pyrimidinyl]amino]-1-butanol IUPAC Name: 2-[[5-phenyl-2-(piperidin-1-ylmethyl)thieno[2,3-d]pyrimidin-4-yl]amino]butan-1-ol Traditional Name: 2-[[5-phenyl-2-(piperidinomethyl)thieno[2,3-d]pyrimidin-4-yl]amino]butan-1-ol Formula: C22H28N4OS MolecularWeight: 396.54892

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CO)NC1=C2C(=CSC2=NC(=N1)CN3CCCCC3)C4=CC=CC=C4

Isomeric SMILES

CCC(CO)NC1=C2C(=CSC2=NC(=N1)CN3CCCCC3)C4=CC=CC=C4

InChI

InChI=1S/C22H28N4OS/c1-2-17(14-27)23-21-20-18(16-9-5-3-6-10-16)15-28-22(20)25-19(24-21)13-26-11-7-4-8-12-26/h3,5-6,9-10,15,17,27H,2,4,7-8,11-14H2,1H3,(H,23,24,25)