ethyl 2-oxidanylidene-2-[3-[5-(phenylmethyl)-1,3,4-thiadiazol-2-yl]piperidin-1-yl]ethanoate

Systemtic Name: ethyl 2-oxidanylidene-2-[3-[5-(phenylmethyl)-1,3,4-thiadiazol-2-yl]piperidin-1-yl]ethanoate Openeye Name: ethyl 2-[3-(5-benzyl-1,3,4-thiadiazol-2-yl)-1-piperidyl]-2-oxo-acetate CAS Name: 2-oxo-2-[3-[5-(phenylmethyl)-1,3,4-thiadiazol-2-yl]-1-piperidinyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[3-(5-benzyl-1,3,4-thiadiazol-2-yl)piperidin-1-yl]-2-oxoacetate Traditional Name: 2-[3-(5-benzyl-1,3,4-thiadiazol-2-yl)piperidino]-2-keto-acetic acid ethyl ester Formula: C18H21N3O3S MolecularWeight: 359.44264

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=O)N1CCCC(C1)C2=NN=C(S2)CC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C(=O)N1CCCC(C1)C2=NN=C(S2)CC3=CC=CC=C3

InChI

InChI=1S/C18H21N3O3S/c1-2-24-18(23)17(22)21-10-6-9-14(12-21)16-20-19-15(25-16)11-13-7-4-3-5-8-13/h3-5,7-8,14H,2,6,9-12H2,1H3