phenethyl 5-methyl-4-phenylazanyl-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: phenethyl 5-methyl-4-phenylazanyl-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: phenethyl 4-anilino-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 4-anilino-5-methyl-6-thieno[2,3-d]pyrimidinecarboxylic acid phenethyl ester IUPAC Name: phenethyl 4-anilino-5-methylthieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-anilino-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid phenethyl ester Formula: C22H19N3O2S MolecularWeight: 389.47016

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC=NC(=C12)NC3=CC=CC=C3)C(=O)OCCC4=CC=CC=C4

Isomeric SMILES

CC1=C(SC2=NC=NC(=C12)NC3=CC=CC=C3)C(=O)OCCC4=CC=CC=C4

InChI

InChI=1S/C22H19N3O2S/c1-15-18-20(25-17-10-6-3-7-11-17)23-14-24-21(18)28-19(15)22(26)27-13-12-16-8-4-2-5-9-16/h2-11,14H,12-13H2,1H3,(H,23,24,25)