3-(2-ethoxyphenyl)-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-(2-ethoxyphenyl)-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-(2-ethoxyphenyl)propanimidate CAS Name: 3-(2-ethoxyphenyl)-N-[4-methyl-5-(4-prop-2-enyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)-2-thiazolyl]propanimidate IUPAC Name: 3-(2-ethoxyphenyl)-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-o-phenetyl-propionimidate Formula: C20H22N5O2S2- MolecularWeight: 428.55098

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1CCC(=NC2=NC(=C(S2)C3=NNC(=S)N3CC=C)C)[O-]

Isomeric SMILES

CCOC1=CC=CC=C1CCC(=NC2=NC(=C(S2)C3=NNC(=S)N3CC=C)C)[O-]

InChI

InChI=1S/C20H23N5O2S2/c1-4-12-25-18(23-24-20(25)28)17-13(3)21-19(29-17)22-16(26)11-10-14-8-6-7-9-15(14)27-5-2/h4,6-9H,1,5,10-12H2,2-3H3,(H,24,28)(H,21,22,26)/p-1