(4-bromophenyl) 5-methyl-4-oxidanylidene-3-propyl-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: (4-bromophenyl) 5-methyl-4-oxidanylidene-3-propyl-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: (4-bromophenyl) 5-methyl-4-oxo-3-propyl-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-methyl-4-oxo-3-propyl-6-thieno[2,3-d]pyrimidinecarboxylic acid (4-bromophenyl) ester IUPAC Name: (4-bromophenyl) 5-methyl-4-oxo-3-propylthieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-keto-5-methyl-3-propyl-thieno[2,3-d]pyrimidine-6-carboxylic acid (4-bromophenyl) ester Formula: C17H15BrN2O3S MolecularWeight: 407.2816

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=NC2=C(C1=O)C(=C(S2)C(=O)OC3=CC=C(C=C3)Br)C

Isomeric SMILES

CCCN1C=NC2=C(C1=O)C(=C(S2)C(=O)OC3=CC=C(C=C3)Br)C

InChI

InChI=1S/C17H15BrN2O3S/c1-3-8-20-9-19-15-13(16(20)21)10(2)14(24-15)17(22)23-12-6-4-11(18)5-7-12/h4-7,9H,3,8H2,1-2H3