methyl 4-methyl-2-[2-[(6-methyl-5-oxidanylidene-2H-1,2,4-triazin-3-yl)sulfanyl]ethanoylamino]pentanoate

Systemtic Name: methyl 4-methyl-2-[2-[(6-methyl-5-oxidanylidene-2H-1,2,4-triazin-3-yl)sulfanyl]ethanoylamino]pentanoate Openeye Name: methyl 4-methyl-2-[[2-[(6-methyl-5-oxo-2H-1,2,4-triazin-3-yl)sulfanyl]acetyl]amino]pentanoate CAS Name: 4-methyl-2-[[2-[(6-methyl-5-oxo-2H-1,2,4-triazin-3-yl)thio]-1-oxoethyl]amino]pentanoic acid methyl ester IUPAC Name: methyl 4-methyl-2-[[2-[(6-methyl-5-oxo-2H-1,2,4-triazin-3-yl)sulfanyl]acetyl]amino]pentanoate Traditional Name: 2-[[2-[(5-keto-6-methyl-2H-1,2,4-triazin-3-yl)thio]acetyl]amino]-4-methyl-valeric acid methyl ester Formula: C13H20N4O4S MolecularWeight: 328.3873

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NNC(=NC1=O)SCC(=O)NC(CC(C)C)C(=O)OC

Isomeric SMILES

CC1=NNC(=NC1=O)SCC(=O)NC(CC(C)C)C(=O)OC

InChI

InChI=1S/C13H20N4O4S/c1-7(2)5-9(12(20)21-4)14-10(18)6-22-13-15-11(19)8(3)16-17-13/h7,9H,5-6H2,1-4H3,(H,14,18)(H,15,17,19)