butyl 3-[2-(4-oxidanylidene-6-phenyl-thieno[2,3-d]pyrimidin-3-yl)ethanoylamino]benzoate

Systemtic Name: butyl 3-[2-(4-oxidanylidene-6-phenyl-thieno[2,3-d]pyrimidin-3-yl)ethanoylamino]benzoate Openeye Name: butyl 3-[[2-(4-oxo-6-phenyl-thieno[2,3-d]pyrimidin-3-yl)acetyl]amino]benzoate CAS Name: 3-[[1-oxo-2-(4-oxo-6-phenyl-3-thieno[2,3-d]pyrimidinyl)ethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 3-[[2-(4-oxo-6-phenylthieno[2,3-d]pyrimidin-3-yl)acetyl]amino]benzoate Traditional Name: 3-[[2-(4-keto-6-phenyl-thieno[2,3-d]pyrimidin-3-yl)acetyl]amino]benzoic acid butyl ester Formula: C25H23N3O4S MolecularWeight: 461.53282

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC(=CC=C1)NC(=O)CN2C=NC3=C(C2=O)C=C(S3)C4=CC=CC=C4

Isomeric SMILES

CCCCOC(=O)C1=CC(=CC=C1)NC(=O)CN2C=NC3=C(C2=O)C=C(S3)C4=CC=CC=C4

InChI

InChI=1S/C25H23N3O4S/c1-2-3-12-32-25(31)18-10-7-11-19(13-18)27-22(29)15-28-16-26-23-20(24(28)30)14-21(33-23)17-8-5-4-6-9-17/h4-11,13-14,16H,2-3,12,15H2,1H3,(H,27,29)