methyl 3-methyl-2-[2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]pentanoate

Systemtic Name: methyl 3-methyl-2-[2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]pentanoate Openeye Name: methyl 3-methyl-2-[[2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]pentanoate CAS Name: 3-methyl-2-[[2-[(4-methyl-1,2,4-triazol-3-yl)thio]-1-oxoethyl]amino]pentanoic acid methyl ester IUPAC Name: methyl 3-methyl-2-[[2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]pentanoate Traditional Name: 3-methyl-2-[[2-[(4-methyl-1,2,4-triazol-3-yl)thio]acetyl]amino]valeric acid methyl ester Formula: C12H20N4O3S MolecularWeight: 300.3772

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)OC)NC(=O)CSC1=NN=CN1C

Isomeric SMILES

CCC(C)C(C(=O)OC)NC(=O)CSC1=NN=CN1C

InChI

InChI=1S/C12H20N4O3S/c1-5-8(2)10(11(18)19-4)14-9(17)6-20-12-15-13-7-16(12)3/h7-8,10H,5-6H2,1-4H3,(H,14,17)