phenyl 2-oxidanylidene-4-(4,5,6,7-tetrahydrothieno[3,2-c]pyridin-2-ylcarbonylamino)butanoate

Systemtic Name: phenyl 2-oxidanylidene-4-(4,5,6,7-tetrahydrothieno[3,2-c]pyridin-2-ylcarbonylamino)butanoate Openeye Name: phenyl 2-oxo-4-(4,5,6,7-tetrahydrothieno[3,2-c]pyridine-2-carbonylamino)butanoate CAS Name: 2-oxo-4-[[oxo(4,5,6,7-tetrahydrothieno[3,2-c]pyridin-2-yl)methyl]amino]butanoic acid phenyl ester IUPAC Name: phenyl 2-oxo-4-(4,5,6,7-tetrahydrothieno[3,2-c]pyridine-2-carbonylamino)butanoate Traditional Name: 2-keto-4-(4,5,6,7-tetrahydrothieno[3,2-c]pyridine-2-carbonylamino)butyric acid phenyl ester Formula: C18H18N2O4S MolecularWeight: 358.41152

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCC2=C1SC(=C2)C(=O)NCCC(=O)C(=O)OC3=CC=CC=C3

Isomeric SMILES

C1CNCC2=C1SC(=C2)C(=O)NCCC(=O)C(=O)OC3=CC=CC=C3

InChI

InChI=1S/C18H18N2O4S/c21-14(18(23)24-13-4-2-1-3-5-13)6-9-20-17(22)16-10-12-11-19-8-7-15(12)25-16/h1-5,10,19H,6-9,11H2,(H,20,22)