phenethyl 4-[2-(1H-benzimidazol-2-yl)ethylamino]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: phenethyl 4-[2-(1H-benzimidazol-2-yl)ethylamino]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: phenethyl 4-[2-(1H-benzimidazol-2-yl)ethylamino]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 4-[2-(1H-benzimidazol-2-yl)ethylamino]-5-methyl-6-thieno[2,3-d]pyrimidinecarboxylic acid phenethyl ester IUPAC Name: phenethyl 4-[2-(1H-benzimidazol-2-yl)ethylamino]-5-methylthieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-[2-(1H-benzimidazol-2-yl)ethylamino]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid phenethyl ester Formula: C25H23N5O2S MolecularWeight: 457.54742

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC=NC(=C12)NCCC3=NC4=CC=CC=C4N3)C(=O)OCCC5=CC=CC=C5

Isomeric SMILES

CC1=C(SC2=NC=NC(=C12)NCCC3=NC4=CC=CC=C4N3)C(=O)OCCC5=CC=CC=C5

InChI

InChI=1S/C25H23N5O2S/c1-16-21-23(26-13-11-20-29-18-9-5-6-10-19(18)30-20)27-15-28-24(21)33-22(16)25(31)32-14-12-17-7-3-2-4-8-17/h2-10,15H,11-14H2,1H3,(H,29,30)(H,26,27,28)