ethyl 5-methyl-4-[4-(4-methylpiperazin-1-yl)butylamino]thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: ethyl 5-methyl-4-[4-(4-methylpiperazin-1-yl)butylamino]thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 5-methyl-4-[4-(4-methylpiperazin-1-yl)butylamino]thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-methyl-4-[4-(4-methyl-1-piperazinyl)butylamino]-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-methyl-4-[4-(4-methylpiperazin-1-yl)butylamino]thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 5-methyl-4-[4-(4-methylpiperazino)butylamino]thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C19H29N5O2S MolecularWeight: 391.53086

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(N=CN=C2S1)NCCCCN3CCN(CC3)C)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(N=CN=C2S1)NCCCCN3CCN(CC3)C)C

InChI

InChI=1S/C19H29N5O2S/c1-4-26-19(25)16-14(2)15-17(21-13-22-18(15)27-16)20-7-5-6-8-24-11-9-23(3)10-12-24/h13H,4-12H2,1-3H3,(H,20,21,22)