ethyl 5-azanyl-4-[3,5-bis(oxidanylidene)pyrazolidin-1-yl]carbonyl-3-methyl-thiophene-2-carboxylate

Systemtic Name: ethyl 5-azanyl-4-[3,5-bis(oxidanylidene)pyrazolidin-1-yl]carbonyl-3-methyl-thiophene-2-carboxylate Openeye Name: ethyl 5-amino-4-(3,5-dioxopyrazolidine-1-carbonyl)-3-methyl-thiophene-2-carboxylate CAS Name: 5-amino-4-[(3,5-dioxo-1-pyrazolidinyl)-oxomethyl]-3-methyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-4-(3,5-dioxopyrazolidine-1-carbonyl)-3-methylthiophene-2-carboxylate Traditional Name: 5-amino-4-(3,5-diketopyrazolidine-1-carbonyl)-3-methyl-thiophene-2-carboxylic acid ethyl ester Formula: C12H13N3O5S MolecularWeight: 311.31372

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)N)C(=O)N2C(=O)CC(=O)N2)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)N)C(=O)N2C(=O)CC(=O)N2)C

InChI

InChI=1S/C12H13N3O5S/c1-3-20-12(19)9-5(2)8(10(13)21-9)11(18)15-7(17)4-6(16)14-15/h3-4,13H2,1-2H3,(H,14,16)