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

Systemtic Name: propyl 3-[[5-(4-bromophenyl)-6-ethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl]methyl]benzoate Openeye Name: propyl 3-[[5-(4-bromophenyl)-6-ethyl-4-oxo-thieno[2,3-d]pyrimidin-3-yl]methyl]benzoate CAS Name: 3-[[5-(4-bromophenyl)-6-ethyl-4-oxo-3-thieno[2,3-d]pyrimidinyl]methyl]benzoic acid propyl ester IUPAC Name: propyl 3-[[5-(4-bromophenyl)-6-ethyl-4-oxothieno[2,3-d]pyrimidin-3-yl]methyl]benzoate Traditional Name: 3-[[5-(4-bromophenyl)-6-ethyl-4-keto-thieno[2,3-d]pyrimidin-3-yl]methyl]benzoic acid propyl ester Formula: C25H23BrN2O3S MolecularWeight: 511.43072

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC(=CC=C1)CN2C=NC3=C(C2=O)C(=C(S3)CC)C4=CC=C(C=C4)Br

Isomeric SMILES

CCCOC(=O)C1=CC(=CC=C1)CN2C=NC3=C(C2=O)C(=C(S3)CC)C4=CC=C(C=C4)Br

InChI

InChI=1S/C25H23BrN2O3S/c1-3-12-31-25(30)18-7-5-6-16(13-18)14-28-15-27-23-22(24(28)29)21(20(4-2)32-23)17-8-10-19(26)11-9-17/h5-11,13,15H,3-4,12,14H2,1-2H3