methyl 2-[2-[(2-azanyl-1,3-thiazol-5-yl)sulfanyl]ethanoylamino]-4-methyl-pentanoate

Systemtic Name: methyl 2-[2-[(2-azanyl-1,3-thiazol-5-yl)sulfanyl]ethanoylamino]-4-methyl-pentanoate Openeye Name: methyl 2-[[2-(2-aminothiazol-5-yl)sulfanylacetyl]amino]-4-methyl-pentanoate CAS Name: 2-[[2-[(2-amino-5-thiazolyl)thio]-1-oxoethyl]amino]-4-methylpentanoic acid methyl ester IUPAC Name: methyl 2-[[2-[(2-amino-1,3-thiazol-5-yl)sulfanyl]acetyl]amino]-4-methylpentanoate Traditional Name: 2-[[2-[(2-aminothiazol-5-yl)thio]acetyl]amino]-4-methyl-valeric acid methyl ester Formula: C12H19N3O3S2 MolecularWeight: 317.42756

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OC)NC(=O)CSC1=CN=C(S1)N

Isomeric SMILES

CC(C)CC(C(=O)OC)NC(=O)CSC1=CN=C(S1)N

InChI

InChI=1S/C12H19N3O3S2/c1-7(2)4-8(11(17)18-3)15-9(16)6-19-10-5-14-12(13)20-10/h5,7-8H,4,6H2,1-3H3,(H2,13,14)(H,15,16)