2-(4-bromanylphenoxy)-N-[4-methyl-5-(4-prop-2-enyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)-1,3-thiazol-2-yl]ethanimidate

Systemtic Name: 2-(4-bromanylphenoxy)-N-[4-methyl-5-(4-prop-2-enyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)-1,3-thiazol-2-yl]ethanimidate Openeye Name: N-[5-(4-allyl-5-thioxo-1H-1,2,4-triazol-3-yl)-4-methyl-thiazol-2-yl]-2-(4-bromophenoxy)ethanimidate CAS Name: 2-(4-bromophenoxy)-N-[4-methyl-5-(4-prop-2-enyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)-2-thiazolyl]ethanimidate IUPAC Name: 2-(4-bromophenoxy)-N-[4-methyl-5-(4-prop-2-enyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)-1,3-thiazol-2-yl]ethanimidate Traditional Name: N-[5-(4-allyl-5-thioxo-1H-1,2,4-triazol-3-yl)-4-methyl-thiazol-2-yl]-2-(4-bromophenoxy)acetimidate Formula: C17H15BrN5O2S2- MolecularWeight: 465.3673

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)N=C(COC2=CC=C(C=C2)Br)[O-])C3=NNC(=S)N3CC=C

Isomeric SMILES

CC1=C(SC(=N1)N=C(COC2=CC=C(C=C2)Br)[O-])C3=NNC(=S)N3CC=C

InChI

InChI=1S/C17H16BrN5O2S2/c1-3-8-23-15(21-22-17(23)26)14-10(2)19-16(27-14)20-13(24)9-25-12-6-4-11(18)5-7-12/h3-7H,1,8-9H2,2H3,(H,22,26)(H,19,20,24)/p-1