methyl 2-[2-(4-oxidanylidene-3-phenethyl-thieno[3,2-d]pyrimidin-2-yl)sulfanylethanoylamino]benzoate

Systemtic Name: methyl 2-[2-(4-oxidanylidene-3-phenethyl-thieno[3,2-d]pyrimidin-2-yl)sulfanylethanoylamino]benzoate Openeye Name: methyl 2-[[2-(4-oxo-3-phenethyl-thieno[3,2-d]pyrimidin-2-yl)sulfanylacetyl]amino]benzoate CAS Name: 2-[[1-oxo-2-[(4-oxo-3-phenethyl-2-thieno[3,2-d]pyrimidinyl)thio]ethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[2-(4-oxo-3-phenethylthieno[3,2-d]pyrimidin-2-yl)sulfanylacetyl]amino]benzoate Traditional Name: 2-[[2-[(4-keto-3-phenethyl-thieno[3,2-d]pyrimidin-2-yl)thio]acetyl]amino]benzoic acid methyl ester Formula: C24H21N3O4S2 MolecularWeight: 479.57124

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1NC(=O)CSC2=NC3=C(C(=O)N2CCC4=CC=CC=C4)SC=C3

Isomeric SMILES

COC(=O)C1=CC=CC=C1NC(=O)CSC2=NC3=C(C(=O)N2CCC4=CC=CC=C4)SC=C3

InChI

InChI=1S/C24H21N3O4S2/c1-31-23(30)17-9-5-6-10-18(17)25-20(28)15-33-24-26-19-12-14-32-21(19)22(29)27(24)13-11-16-7-3-2-4-8-16/h2-10,12,14H,11,13,15H2,1H3,(H,25,28)