N-[5-[2-[(4-ethanoylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-2-piperidin-1-ium-1-yl-ethanimidate

Systemtic Name: N-[5-[2-[(4-ethanoylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-2-piperidin-1-ium-1-yl-ethanimidate Openeye Name: N-[5-[2-(4-acetylanilino)-2-oxo-ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-2-piperidin-1-ium-1-yl-ethanimidate CAS Name: N-[5-[[2-(4-acetylanilino)-2-oxoethyl]thio]-1,3,4-thiadiazol-2-yl]-2-(1-piperidin-1-iumyl)ethanimidate IUPAC Name: N-[5-[2-(4-acetylanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-2-piperidin-1-ium-1-ylethanimidate Traditional Name: N-[5-[[2-(4-acetylanilino)-2-keto-ethyl]thio]-1,3,4-thiadiazol-2-yl]-2-piperidin-1-ium-1-yl-acetimidate Formula: C19H23N5O3S2 MolecularWeight: 433.54762

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NN=C(S2)N=C(C[NH+]3CCCCC3)[O-]

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NN=C(S2)N=C(C[NH+]3CCCCC3)[O-]

InChI

InChI=1S/C19H23N5O3S2/c1-13(25)14-5-7-15(8-6-14)20-17(27)12-28-19-23-22-18(29-19)21-16(26)11-24-9-3-2-4-10-24/h5-8H,2-4,9-12H2,1H3,(H,20,27)(H,21,22,26)