ethyl 2-[2-[(4-prop-2-enyl-5-pyrazin-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]ethanoate

Systemtic Name: ethyl 2-[2-[(4-prop-2-enyl-5-pyrazin-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]ethanoate Openeye Name: ethyl 2-[[2-[(4-allyl-5-pyrazin-2-yl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]acetate CAS Name: 2-[[1-oxo-2-[[4-prop-2-enyl-5-(2-pyrazinyl)-1,2,4-triazol-3-yl]thio]ethyl]amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[[2-[(4-prop-2-enyl-5-pyrazin-2-yl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]acetate Traditional Name: 2-[[2-[(4-allyl-5-pyrazin-2-yl-1,2,4-triazol-3-yl)thio]acetyl]amino]acetic acid ethyl ester Formula: C15H18N6O3S MolecularWeight: 362.40682

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CNC(=O)CSC1=NN=C(N1CC=C)C2=NC=CN=C2

Isomeric SMILES

CCOC(=O)CNC(=O)CSC1=NN=C(N1CC=C)C2=NC=CN=C2

InChI

InChI=1S/C15H18N6O3S/c1-3-7-21-14(11-8-16-5-6-17-11)19-20-15(21)25-10-12(22)18-9-13(23)24-4-2/h3,5-6,8H,1,4,7,9-10H2,2H3,(H,18,22)