ethyl 5-methyl-2-(morpholin-4-ylmethyl)-4-phenoxy-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: ethyl 5-methyl-2-(morpholin-4-ylmethyl)-4-phenoxy-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 5-methyl-2-(morpholinomethyl)-4-phenoxy-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-methyl-2-(4-morpholinylmethyl)-4-phenoxy-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-methyl-2-(morpholin-4-ylmethyl)-4-phenoxythieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 5-methyl-2-(morpholinomethyl)-4-phenoxy-thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C21H23N3O4S MolecularWeight: 413.49002

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(N=C(N=C2S1)CN3CCOCC3)OC4=CC=CC=C4)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(N=C(N=C2S1)CN3CCOCC3)OC4=CC=CC=C4)C

InChI

InChI=1S/C21H23N3O4S/c1-3-27-21(25)18-14(2)17-19(28-15-7-5-4-6-8-15)22-16(23-20(17)29-18)13-24-9-11-26-12-10-24/h4-8H,3,9-13H2,1-2H3