N-(4-ethoxycarbonyl-1,3-thiazol-2-yl)-2-(4-methylpiperazin-1-ium-1-yl)ethanimidate

Systemtic Name: N-(4-ethoxycarbonyl-1,3-thiazol-2-yl)-2-(4-methylpiperazin-1-ium-1-yl)ethanimidate Openeye Name: N-(4-ethoxycarbonylthiazol-2-yl)-2-(4-methylpiperazin-1-ium-1-yl)ethanimidate CAS Name: N-(4-ethoxycarbonyl-2-thiazolyl)-2-(4-methyl-1-piperazin-1-iumyl)ethanimidate IUPAC Name: N-(4-ethoxycarbonyl-1,3-thiazol-2-yl)-2-(4-methylpiperazin-1-ium-1-yl)ethanimidate Traditional Name: N-(4-carbethoxythiazol-2-yl)-2-(4-methylpiperazin-1-ium-1-yl)acetimidate Formula: C13H20N4O3S MolecularWeight: 312.3879

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CSC(=N1)N=C(C[NH+]2CCN(CC2)C)[O-]

Isomeric SMILES

CCOC(=O)C1=CSC(=N1)N=C(C[NH+]2CCN(CC2)C)[O-]

InChI

InChI=1S/C13H20N4O3S/c1-3-20-12(19)10-9-21-13(14-10)15-11(18)8-17-6-4-16(2)5-7-17/h9H,3-8H2,1-2H3,(H,14,15,18)