1-(1,3-benzodioxol-5-yloxy)-3-[(1-thieno[2,3-d]pyrimidin-4-ylpiperidin-4-yl)amino]propan-2-ol

Systemtic Name: 1-(1,3-benzodioxol-5-yloxy)-3-[(1-thieno[2,3-d]pyrimidin-4-ylpiperidin-4-yl)amino]propan-2-ol Openeye Name: 1-(1,3-benzodioxol-5-yloxy)-3-[(1-thieno[2,3-d]pyrimidin-4-yl-4-piperidyl)amino]propan-2-ol CAS Name: 1-(1,3-benzodioxol-5-yloxy)-3-[[1-(4-thieno[2,3-d]pyrimidinyl)-4-piperidinyl]amino]-2-propanol IUPAC Name: 1-(1,3-benzodioxol-5-yloxy)-3-[(1-thieno[2,3-d]pyrimidin-4-ylpiperidin-4-yl)amino]propan-2-ol Traditional Name: 1-(1,3-benzodioxol-5-yloxy)-3-[(1-thieno[2,3-d]pyrimidin-4-yl-4-piperidyl)amino]propan-2-ol Formula: C21H24N4O4S MolecularWeight: 428.50466

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NCC(COC2=CC3=C(C=C2)OCO3)O)C4=C5C=CSC5=NC=N4

Isomeric SMILES

C1CN(CCC1NCC(COC2=CC3=C(C=C2)OCO3)O)C4=C5C=CSC5=NC=N4

InChI

InChI=1S/C21H24N4O4S/c26-15(11-27-16-1-2-18-19(9-16)29-13-28-18)10-22-14-3-6-25(7-4-14)20-17-5-8-30-21(17)24-12-23-20/h1-2,5,8-9,12,14-15,22,26H,3-4,6-7,10-11,13H2