[2-(azocan-1-yl)-2-oxidanylidene-ethyl] 2-thiophen-2-yl-1,3-thiazole-4-carboxylate

Systemtic Name: [2-(azocan-1-yl)-2-oxidanylidene-ethyl] 2-thiophen-2-yl-1,3-thiazole-4-carboxylate Openeye Name: [2-(azocan-1-yl)-2-oxo-ethyl] 2-(2-thienyl)thiazole-4-carboxylate CAS Name: 2-thiophen-2-yl-4-thiazolecarboxylic acid [2-(1-azocanyl)-2-oxoethyl] ester IUPAC Name: [2-(azocan-1-yl)-2-oxoethyl] 2-thiophen-2-yl-1,3-thiazole-4-carboxylate Traditional Name: 2-(2-thienyl)thiazole-4-carboxylic acid [2-(azocan-1-yl)-2-keto-ethyl] ester Formula: C17H20N2O3S2 MolecularWeight: 364.4823

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CCC1)C(=O)COC(=O)C2=CSC(=N2)C3=CC=CS3

Isomeric SMILES

C1CCCN(CCC1)C(=O)COC(=O)C2=CSC(=N2)C3=CC=CS3

InChI

InChI=1S/C17H20N2O3S2/c20-15(19-8-4-2-1-3-5-9-19)11-22-17(21)13-12-24-16(18-13)14-7-6-10-23-14/h6-7,10,12H,1-5,8-9,11H2