2-methylpropyl 2-[[3-(2-ethoxy-2-oxidanylidene-ethyl)sulfanyl-5-oxidanylidene-2H-1,2,4-triazin-6-yl]amino]ethanoate

Systemtic Name: 2-methylpropyl 2-[[3-(2-ethoxy-2-oxidanylidene-ethyl)sulfanyl-5-oxidanylidene-2H-1,2,4-triazin-6-yl]amino]ethanoate Openeye Name: isobutyl 2-[[3-(2-ethoxy-2-oxo-ethyl)sulfanyl-5-oxo-2H-1,2,4-triazin-6-yl]amino]acetate CAS Name: 2-[[3-[(2-ethoxy-2-oxoethyl)thio]-5-oxo-2H-1,2,4-triazin-6-yl]amino]acetic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 2-[[3-(2-ethoxy-2-oxoethyl)sulfanyl-5-oxo-2H-1,2,4-triazin-6-yl]amino]acetate Traditional Name: 2-[[3-[(2-ethoxy-2-keto-ethyl)thio]-5-keto-2H-1,2,4-triazin-6-yl]amino]acetic acid isobutyl ester Formula: C13H20N4O5S MolecularWeight: 344.3867

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=NC(=O)C(=NN1)NCC(=O)OCC(C)C

Isomeric SMILES

CCOC(=O)CSC1=NC(=O)C(=NN1)NCC(=O)OCC(C)C

InChI

InChI=1S/C13H20N4O5S/c1-4-21-10(19)7-23-13-15-12(20)11(16-17-13)14-5-9(18)22-6-8(2)3/h8H,4-7H2,1-3H3,(H,14,16)(H,15,17,20)