ethyl (2E)-2-(azanylmethylidene)-3,5-bis(oxidanylidene)-5-thiophen-2-yl-pentanoate

Systemtic Name: ethyl (2E)-2-(azanylmethylidene)-3,5-bis(oxidanylidene)-5-thiophen-2-yl-pentanoate Openeye Name: ethyl (2E)-2-(aminomethylene)-3,5-dioxo-5-(2-thienyl)pentanoate CAS Name: (2E)-2-(aminomethylidene)-3,5-dioxo-5-thiophen-2-ylpentanoic acid ethyl ester IUPAC Name: ethyl (2E)-2-(aminomethylidene)-3,5-dioxo-5-thiophen-2-ylpentanoate Traditional Name: (E)-3-amino-2-[3-keto-3-(2-thienyl)propanoyl]acrylic acid ethyl ester Formula: C12H13NO4S MolecularWeight: 267.30092

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CN)C(=O)CC(=O)C1=CC=CS1

Isomeric SMILES

CCOC(=O)/C(=C/N)/C(=O)CC(=O)C1=CC=CS1

InChI

InChI=1S/C12H13NO4S/c1-2-17-12(16)8(7-13)9(14)6-10(15)11-4-3-5-18-11/h3-5,7H,2,6,13H2,1H3/b8-7+