2-[2-ethoxy-4-[(Z)-(5-sulfanylidene-1H-1,2,4-triazol-4-yl)iminomethyl]phenoxy]-1-piperidin-1-yl-ethanone

Systemtic Name: 2-[2-ethoxy-4-[(Z)-(5-sulfanylidene-1H-1,2,4-triazol-4-yl)iminomethyl]phenoxy]-1-piperidin-1-yl-ethanone Openeye Name: 2-[2-ethoxy-4-[(Z)-(5-thioxo-1H-1,2,4-triazol-4-yl)iminomethyl]phenoxy]-1-(1-piperidyl)ethanone CAS Name: 2-[2-ethoxy-4-[(Z)-(5-sulfanylidene-1H-1,2,4-triazol-4-yl)iminomethyl]phenoxy]-1-(1-piperidinyl)ethanone IUPAC Name: 2-[2-ethoxy-4-[(Z)-(5-sulfanylidene-1H-1,2,4-triazol-4-yl)iminomethyl]phenoxy]-1-piperidin-1-ylethanone Traditional Name: 2-[2-ethoxy-4-[(Z)-(5-thioxo-1H-1,2,4-triazol-4-yl)iminomethyl]phenoxy]-1-piperidino-ethanone Formula: C18H23N5O3S MolecularWeight: 389.47192

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=NN2C=NNC2=S)OCC(=O)N3CCCCC3

Isomeric SMILES

CCOC1=C(C=CC(=C1)/C=N\N2C=NNC2=S)OCC(=O)N3CCCCC3

InChI

InChI=1S/C18H23N5O3S/c1-2-25-16-10-14(11-20-23-13-19-21-18(23)27)6-7-15(16)26-12-17(24)22-8-4-3-5-9-22/h6-7,10-11,13H,2-5,8-9,12H2,1H3,(H,21,27)/b20-11-