[1-(azepan-1-yl)-1-oxidanylidene-propan-2-yl] 2-thiophen-3-yl-1,3-thiazole-4-carboxylate

Systemtic Name: [1-(azepan-1-yl)-1-oxidanylidene-propan-2-yl] 2-thiophen-3-yl-1,3-thiazole-4-carboxylate Openeye Name: [2-(azepan-1-yl)-1-methyl-2-oxo-ethyl] 2-(3-thienyl)thiazole-4-carboxylate CAS Name: 2-(3-thiophenyl)-4-thiazolecarboxylic acid [1-(1-azepanyl)-1-oxopropan-2-yl] ester IUPAC Name: [1-(azepan-1-yl)-1-oxopropan-2-yl] 2-thiophen-3-yl-1,3-thiazole-4-carboxylate Traditional Name: 2-(3-thienyl)thiazole-4-carboxylic acid [2-(azepan-1-yl)-2-keto-1-methyl-ethyl] ester Formula: C17H20N2O3S2 MolecularWeight: 364.4823

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCCCCC1)OC(=O)C2=CSC(=N2)C3=CSC=C3

Isomeric SMILES

CC(C(=O)N1CCCCCC1)OC(=O)C2=CSC(=N2)C3=CSC=C3

InChI

InChI=1S/C17H20N2O3S2/c1-12(16(20)19-7-4-2-3-5-8-19)22-17(21)14-11-24-15(18-14)13-6-9-23-10-13/h6,9-12H,2-5,7-8H2,1H3