N-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-methyl-4-(4-methylpiperazin-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-methyl-4-(4-methylpiperazin-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-methyl-4-(4-methylpiperazin-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-methyl-4-(4-methyl-1-piperazinyl)-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-methyl-4-(4-methylpiperazin-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-methyl-4-(4-methylpiperazino)thieno[2,3-d]pyrimidine-6-carboxamide Formula: C21H23N5O3S MolecularWeight: 425.50402

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC=NC(=C12)N3CCN(CC3)C)C(=O)NC4=CC5=C(C=C4)OCCO5

Isomeric SMILES

CC1=C(SC2=NC=NC(=C12)N3CCN(CC3)C)C(=O)NC4=CC5=C(C=C4)OCCO5

InChI

InChI=1S/C21H23N5O3S/c1-13-17-19(26-7-5-25(2)6-8-26)22-12-23-21(17)30-18(13)20(27)24-14-3-4-15-16(11-14)29-10-9-28-15/h3-4,11-12H,5-10H2,1-2H3,(H,24,27)