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

Systemtic Name: 3-benzamido-N-[4-methyl-5-(4-prop-2-enyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)-1,3-thiazol-2-yl]propanimidate Openeye Name: N-[5-(4-allyl-5-thioxo-1H-1,2,4-triazol-3-yl)-4-methyl-thiazol-2-yl]-3-benzamido-propanimidate CAS Name: 3-benzamido-N-[4-methyl-5-(4-prop-2-enyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)-2-thiazolyl]propanimidate IUPAC Name: 3-benzamido-N-[4-methyl-5-(4-prop-2-enyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)-1,3-thiazol-2-yl]propanimidate Traditional Name: N-[5-(4-allyl-5-thioxo-1H-1,2,4-triazol-3-yl)-4-methyl-thiazol-2-yl]-3-benzamido-propionimidate Formula: C19H19N6O2S2- MolecularWeight: 427.52316

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20N6O2S2/c1-3-11-25-16(23-24-19(25)28)15-12(2)21-18(29-15)22-14(26)9-10-20-17(27)13-7-5-4-6-8-13/h3-8H,1,9-11H2,2H3,(H,20,27)(H,24,28)(H,21,22,26)/p-1