ethyl 5-azanyl-1-[5-(4-fluorophenyl)-6-methyl-thieno[2,3-d]pyrimidin-4-yl]pyrazole-4-carboxylate

Systemtic Name: ethyl 5-azanyl-1-[5-(4-fluorophenyl)-6-methyl-thieno[2,3-d]pyrimidin-4-yl]pyrazole-4-carboxylate Openeye Name: ethyl 5-amino-1-[5-(4-fluorophenyl)-6-methyl-thieno[2,3-d]pyrimidin-4-yl]pyrazole-4-carboxylate CAS Name: 5-amino-1-[5-(4-fluorophenyl)-6-methyl-4-thieno[2,3-d]pyrimidinyl]-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-1-[5-(4-fluorophenyl)-6-methylthieno[2,3-d]pyrimidin-4-yl]pyrazole-4-carboxylate Traditional Name: 5-amino-1-[5-(4-fluorophenyl)-6-methyl-thieno[2,3-d]pyrimidin-4-yl]pyrazole-4-carboxylic acid ethyl ester Formula: C19H16FN5O2S MolecularWeight: 397.426043

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=C3C(=C(SC3=NC=N2)C)C4=CC=C(C=C4)F)N

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=C3C(=C(SC3=NC=N2)C)C4=CC=C(C=C4)F)N

InChI

InChI=1S/C19H16FN5O2S/c1-3-27-19(26)13-8-24-25(16(13)21)17-15-14(11-4-6-12(20)7-5-11)10(2)28-18(15)23-9-22-17/h4-9H,3,21H2,1-2H3