[(2R)-1-(aminocarbonylamino)-3-methyl-1-oxidanylidene-butan-2-yl] 2-(4-methylpiperidin-1-yl)carbothioylsulfanylethanoate

Systemtic Name: [(2R)-1-(aminocarbonylamino)-3-methyl-1-oxidanylidene-butan-2-yl] 2-(4-methylpiperidin-1-yl)carbothioylsulfanylethanoate Openeye Name: [(1R)-1-allophanoyl-2-methyl-propyl] 2-(4-methylpiperidine-1-carbothioyl)sulfanylacetate CAS Name: 2-[[(4-methyl-1-piperidinyl)-sulfanylidenemethyl]thio]acetic acid [(2R)-1-(carbamoylamino)-3-methyl-1-oxobutan-2-yl] ester IUPAC Name: [(2R)-1-(carbamoylamino)-3-methyl-1-oxobutan-2-yl] 2-(4-methylpiperidine-1-carbothioyl)sulfanylacetate Traditional Name: 2-[(4-methylpiperidine-1-carbothioyl)thio]acetic acid [(1R)-1-allophanoyl-2-methyl-propyl] ester Formula: C15H25N3O4S2 MolecularWeight: 375.5067

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=S)SCC(=O)OC(C(C)C)C(=O)NC(=O)N

Isomeric SMILES

CC1CCN(CC1)C(=S)SCC(=O)O[C@H](C(C)C)C(=O)NC(=O)N

InChI

InChI=1S/C15H25N3O4S2/c1-9(2)12(13(20)17-14(16)21)22-11(19)8-24-15(23)18-6-4-10(3)5-7-18/h9-10,12H,4-8H2,1-3H3,(H3,16,17,20,21)/t12-/m1/s1