propyl 2-[5-(4-bromophenyl)-6-ethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl]propanoate

Systemtic Name: propyl 2-[5-(4-bromophenyl)-6-ethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl]propanoate Openeye Name: propyl 2-[5-(4-bromophenyl)-6-ethyl-4-oxo-thieno[2,3-d]pyrimidin-3-yl]propanoate CAS Name: 2-[5-(4-bromophenyl)-6-ethyl-4-oxo-3-thieno[2,3-d]pyrimidinyl]propanoic acid propyl ester IUPAC Name: propyl 2-[5-(4-bromophenyl)-6-ethyl-4-oxothieno[2,3-d]pyrimidin-3-yl]propanoate Traditional Name: 2-[5-(4-bromophenyl)-6-ethyl-4-keto-thieno[2,3-d]pyrimidin-3-yl]propionic acid propyl ester Formula: C20H21BrN2O3S MolecularWeight: 449.36134

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C(C)N1C=NC2=C(C1=O)C(=C(S2)CC)C3=CC=C(C=C3)Br

Isomeric SMILES

CCCOC(=O)C(C)N1C=NC2=C(C1=O)C(=C(S2)CC)C3=CC=C(C=C3)Br

InChI

InChI=1S/C20H21BrN2O3S/c1-4-10-26-20(25)12(3)23-11-22-18-17(19(23)24)16(15(5-2)27-18)13-6-8-14(21)9-7-13/h6-9,11-12H,4-5,10H2,1-3H3