4-[4-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)piperazin-1-yl]-6-phenyl-thieno[2,3-d]pyrimidine

Systemtic Name: 4-[4-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)piperazin-1-yl]-6-phenyl-thieno[2,3-d]pyrimidine Openeye Name: 4-[4-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)piperazin-1-yl]-6-phenyl-thieno[2,3-d]pyrimidine CAS Name: 4-[4-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-1-piperazinyl]-6-phenylthieno[2,3-d]pyrimidine IUPAC Name: 4-[4-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)piperazin-1-yl]-6-phenylthieno[2,3-d]pyrimidine Traditional Name: 4-[4-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)piperazino]-6-phenyl-thieno[2,3-d]pyrimidine Formula: C25H24N4O2S MolecularWeight: 444.54866

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC3=C(C=C2)OCCO3)C4=C5C=C(SC5=NC=N4)C6=CC=CC=C6

Isomeric SMILES

C1CN(CCN1CC2=CC3=C(C=C2)OCCO3)C4=C5C=C(SC5=NC=N4)C6=CC=CC=C6

InChI

InChI=1S/C25H24N4O2S/c1-2-4-19(5-3-1)23-15-20-24(26-17-27-25(20)32-23)29-10-8-28(9-11-29)16-18-6-7-21-22(14-18)31-13-12-30-21/h1-7,14-15,17H,8-13,16H2