ethyl 2-[1-(2H-benzotriazol-5-ylcarbonyl)piperidin-4-yl]-1,3-thiazole-4-carboxylate

Systemtic Name: ethyl 2-[1-(2H-benzotriazol-5-ylcarbonyl)piperidin-4-yl]-1,3-thiazole-4-carboxylate Openeye Name: ethyl 2-[1-(2H-benzotriazole-5-carbonyl)-4-piperidyl]thiazole-4-carboxylate CAS Name: 2-[1-[2H-benzotriazol-5-yl(oxo)methyl]-4-piperidinyl]-4-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[1-(2H-benzotriazole-5-carbonyl)piperidin-4-yl]-1,3-thiazole-4-carboxylate Traditional Name: 2-[1-(2H-benzotriazole-5-carbonyl)-4-piperidyl]thiazole-4-carboxylic acid ethyl ester Formula: C18H19N5O3S MolecularWeight: 385.44016

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CSC(=N1)C2CCN(CC2)C(=O)C3=CC4=NNN=C4C=C3

Isomeric SMILES

CCOC(=O)C1=CSC(=N1)C2CCN(CC2)C(=O)C3=CC4=NNN=C4C=C3

InChI

InChI=1S/C18H19N5O3S/c1-2-26-18(25)15-10-27-16(19-15)11-5-7-23(8-6-11)17(24)12-3-4-13-14(9-12)21-22-20-13/h3-4,9-11H,2,5-8H2,1H3,(H,20,21,22)