phenethyl 5-methyl-4-piperazin-1-yl-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: phenethyl 5-methyl-4-piperazin-1-yl-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: phenethyl 5-methyl-4-piperazin-1-yl-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-methyl-4-(1-piperazinyl)-6-thieno[2,3-d]pyrimidinecarboxylic acid phenethyl ester IUPAC Name: phenethyl 5-methyl-4-piperazin-1-ylthieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 5-methyl-4-piperazino-thieno[2,3-d]pyrimidine-6-carboxylic acid phenethyl ester Formula: C20H22N4O2S MolecularWeight: 382.47928

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC=NC(=C12)N3CCNCC3)C(=O)OCCC4=CC=CC=C4

Isomeric SMILES

CC1=C(SC2=NC=NC(=C12)N3CCNCC3)C(=O)OCCC4=CC=CC=C4

InChI

InChI=1S/C20H22N4O2S/c1-14-16-18(24-10-8-21-9-11-24)22-13-23-19(16)27-17(14)20(25)26-12-7-15-5-3-2-4-6-15/h2-6,13,21H,7-12H2,1H3