(1-cyanoindolizin-2-yl)methyl 2-(thiophen-2-ylcarbonylamino)ethanoate

Systemtic Name: (1-cyanoindolizin-2-yl)methyl 2-(thiophen-2-ylcarbonylamino)ethanoate Openeye Name: (1-cyanoindolizin-2-yl)methyl 2-(thiophene-2-carbonylamino)acetate CAS Name: 2-[[oxo(thiophen-2-yl)methyl]amino]acetic acid (1-cyano-2-indolizinyl)methyl ester IUPAC Name: (1-cyanoindolizin-2-yl)methyl 2-(thiophene-2-carbonylamino)acetate Traditional Name: 2-(2-thenoylamino)acetic acid (1-cyanoindolizin-2-yl)methyl ester Formula: C17H13N3O3S MolecularWeight: 339.36842

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=CN2C=C1)COC(=O)CNC(=O)C3=CC=CS3)C#N

Isomeric SMILES

C1=CC2=C(C(=CN2C=C1)COC(=O)CNC(=O)C3=CC=CS3)C#N

InChI

InChI=1S/C17H13N3O3S/c18-8-13-12(10-20-6-2-1-4-14(13)20)11-23-16(21)9-19-17(22)15-5-3-7-24-15/h1-7,10H,9,11H2,(H,19,22)