N-[4-(2-ethoxy-2-oxidanylidene-ethyl)-1,3-thiazol-2-yl]-2-(4-pyridin-2-ylpiperazin-1-ium-1-yl)ethanimidate

Systemtic Name: N-[4-(2-ethoxy-2-oxidanylidene-ethyl)-1,3-thiazol-2-yl]-2-(4-pyridin-2-ylpiperazin-1-ium-1-yl)ethanimidate Openeye Name: N-[4-(2-ethoxy-2-oxo-ethyl)thiazol-2-yl]-2-[4-(2-pyridyl)piperazin-1-ium-1-yl]ethanimidate CAS Name: N-[4-(2-ethoxy-2-oxoethyl)-2-thiazolyl]-2-[4-(2-pyridinyl)-1-piperazin-1-iumyl]ethanimidate IUPAC Name: N-[4-(2-ethoxy-2-oxoethyl)-1,3-thiazol-2-yl]-2-(4-pyridin-2-ylpiperazin-1-ium-1-yl)ethanimidate Traditional Name: N-[4-(2-ethoxy-2-keto-ethyl)thiazol-2-yl]-2-[4-(2-pyridyl)piperazin-1-ium-1-yl]acetimidate Formula: C18H23N5O3S MolecularWeight: 389.47192

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=CSC(=N1)N=C(C[NH+]2CCN(CC2)C3=CC=CC=N3)[O-]

Isomeric SMILES

CCOC(=O)CC1=CSC(=N1)N=C(C[NH+]2CCN(CC2)C3=CC=CC=N3)[O-]

InChI

InChI=1S/C18H23N5O3S/c1-2-26-17(25)11-14-13-27-18(20-14)21-16(24)12-22-7-9-23(10-8-22)15-5-3-4-6-19-15/h3-6,13H,2,7-12H2,1H3,(H,20,21,24)