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

Systemtic Name: ethyl 2-[2-[(5-phenyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]ethanoate Openeye Name: ethyl 2-[[2-[(4-allyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]acetate CAS Name: 2-[[1-oxo-2-[(5-phenyl-4-prop-2-enyl-1,2,4-triazol-3-yl)thio]ethyl]amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[[2-[(5-phenyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]acetate Traditional Name: 2-[[2-[(4-allyl-5-phenyl-1,2,4-triazol-3-yl)thio]acetyl]amino]acetic acid ethyl ester Formula: C17H20N4O3S MolecularWeight: 360.4307

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CNC(=O)CSC1=NN=C(N1CC=C)C2=CC=CC=C2

Isomeric SMILES

CCOC(=O)CNC(=O)CSC1=NN=C(N1CC=C)C2=CC=CC=C2

InChI

InChI=1S/C17H20N4O3S/c1-3-10-21-16(13-8-6-5-7-9-13)19-20-17(21)25-12-14(22)18-11-15(23)24-4-2/h3,5-9H,1,4,10-12H2,2H3,(H,18,22)