4-azanyl-5-(3,4-dimethoxyphenyl)-7-(4-fluorophenyl)-3H-pyrido[2,3-d]pyrimidine-2-thione

Systemtic Name: 4-azanyl-5-(3,4-dimethoxyphenyl)-7-(4-fluorophenyl)-3H-pyrido[2,3-d]pyrimidine-2-thione Openeye Name: 4-amino-5-(3,4-dimethoxyphenyl)-7-(4-fluorophenyl)-3H-pyrido[2,3-d]pyrimidine-2-thione CAS Name: 4-amino-5-(3,4-dimethoxyphenyl)-7-(4-fluorophenyl)-3H-pyrido[2,3-d]pyrimidine-2-thione IUPAC Name: 4-amino-5-(3,4-dimethoxyphenyl)-7-(4-fluorophenyl)-3H-pyrido[2,3-d]pyrimidine-2-thione Traditional Name: 4-amino-5-(3,4-dimethoxyphenyl)-7-(4-fluorophenyl)-3H-pyrido[2,3-d]pyrimidine-2-thione Formula: C21H17FN4O2S MolecularWeight: 408.448683

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CC(=NC3=NC(=S)NC(=C23)N)C4=CC=C(C=C4)F)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CC(=NC3=NC(=S)NC(=C23)N)C4=CC=C(C=C4)F)OC

InChI

InChI=1S/C21H17FN4O2S/c1-27-16-8-5-12(9-17(16)28-2)14-10-15(11-3-6-13(22)7-4-11)24-20-18(14)19(23)25-21(29)26-20/h3-10H,1-2H3,(H3,23,24,25,26,29)