5-[[6-ethyl-5-(4-propan-2-ylphenyl)thieno[2,3-d]pyrimidin-4-yl]amino]pentan-1-ol

Systemtic Name: 5-[[6-ethyl-5-(4-propan-2-ylphenyl)thieno[2,3-d]pyrimidin-4-yl]amino]pentan-1-ol Openeye Name: 5-[[6-ethyl-5-(4-isopropylphenyl)thieno[2,3-d]pyrimidin-4-yl]amino]pentan-1-ol CAS Name: 5-[[6-ethyl-5-(4-propan-2-ylphenyl)-4-thieno[2,3-d]pyrimidinyl]amino]-1-pentanol IUPAC Name: 5-[[6-ethyl-5-(4-propan-2-ylphenyl)thieno[2,3-d]pyrimidin-4-yl]amino]pentan-1-ol Traditional Name: 5-[(6-ethyl-5-p-cumenyl-thieno[2,3-d]pyrimidin-4-yl)amino]pentan-1-ol Formula: C22H29N3OS MolecularWeight: 383.55016

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=C(N=CN=C2S1)NCCCCCO)C3=CC=C(C=C3)C(C)C

Isomeric SMILES

CCC1=C(C2=C(N=CN=C2S1)NCCCCCO)C3=CC=C(C=C3)C(C)C

InChI

InChI=1S/C22H29N3OS/c1-4-18-19(17-10-8-16(9-11-17)15(2)3)20-21(23-12-6-5-7-13-26)24-14-25-22(20)27-18/h8-11,14-15,26H,4-7,12-13H2,1-3H3,(H,23,24,25)