ethyl 4-[2-(5-cyclopropyl-4-oxidanylidene-3-phenyl-thieno[2,3-d]pyrimidin-2-yl)sulfanylethanoylamino]butanoate

Systemtic Name: ethyl 4-[2-(5-cyclopropyl-4-oxidanylidene-3-phenyl-thieno[2,3-d]pyrimidin-2-yl)sulfanylethanoylamino]butanoate Openeye Name: ethyl 4-[[2-(5-cyclopropyl-4-oxo-3-phenyl-thieno[2,3-d]pyrimidin-2-yl)sulfanylacetyl]amino]butanoate CAS Name: 4-[[2-[(5-cyclopropyl-4-oxo-3-phenyl-2-thieno[2,3-d]pyrimidinyl)thio]-1-oxoethyl]amino]butanoic acid ethyl ester IUPAC Name: ethyl 4-[[2-(5-cyclopropyl-4-oxo-3-phenylthieno[2,3-d]pyrimidin-2-yl)sulfanylacetyl]amino]butanoate Traditional Name: 4-[[2-[(5-cyclopropyl-4-keto-3-phenyl-thieno[2,3-d]pyrimidin-2-yl)thio]acetyl]amino]butyric acid ethyl ester Formula: C23H25N3O4S2 MolecularWeight: 471.5923

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCNC(=O)CSC1=NC2=C(C(=CS2)C3CC3)C(=O)N1C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)CCCNC(=O)CSC1=NC2=C(C(=CS2)C3CC3)C(=O)N1C4=CC=CC=C4

InChI

InChI=1S/C23H25N3O4S2/c1-2-30-19(28)9-6-12-24-18(27)14-32-23-25-21-20(17(13-31-21)15-10-11-15)22(29)26(23)16-7-4-3-5-8-16/h3-5,7-8,13,15H,2,6,9-12,14H2,1H3,(H,24,27)