4-[4-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)piperazin-1-yl]-2-methyl-5-thiophen-2-yl-thieno[2,3-d]pyrimidine

Systemtic Name: 4-[4-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)piperazin-1-yl]-2-methyl-5-thiophen-2-yl-thieno[2,3-d]pyrimidine Openeye Name: 4-[4-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)piperazin-1-yl]-2-methyl-5-(2-thienyl)thieno[2,3-d]pyrimidine CAS Name: 4-[4-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-1-piperazinyl]-2-methyl-5-thiophen-2-ylthieno[2,3-d]pyrimidine IUPAC Name: 4-[4-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)piperazin-1-yl]-2-methyl-5-thiophen-2-ylthieno[2,3-d]pyrimidine Traditional Name: 4-[4-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)piperazino]-2-methyl-5-(2-thienyl)thieno[2,3-d]pyrimidine Formula: C24H24N4O2S2 MolecularWeight: 464.60296

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C2C(=CSC2=N1)C3=CC=CS3)N4CCN(CC4)CC5=CC6=C(C=C5)OCCO6

Isomeric SMILES

CC1=NC(=C2C(=CSC2=N1)C3=CC=CS3)N4CCN(CC4)CC5=CC6=C(C=C5)OCCO6

InChI

InChI=1S/C24H24N4O2S2/c1-16-25-23(22-18(15-32-24(22)26-16)21-3-2-12-31-21)28-8-6-27(7-9-28)14-17-4-5-19-20(13-17)30-11-10-29-19/h2-5,12-13,15H,6-11,14H2,1H3