[1-[2-[(N'-cyanocarbamimidoyl)-methyl-amino]ethylsulfanyl]-3-oxidanylidene-butan-2-yl] ethanoate

Systemtic Name: [1-[2-[(N'-cyanocarbamimidoyl)-methyl-amino]ethylsulfanyl]-3-oxidanylidene-butan-2-yl] ethanoate Openeye Name: [1-[2-[(N'-cyanocarbamimidoyl)-methyl-amino]ethylsulfanylmethyl]-2-oxo-propyl] acetate CAS Name: acetic acid [1-[2-[[amino(cyanoimino)methyl]-methylamino]ethylthio]-3-oxobutan-2-yl] ester IUPAC Name: [1-[2-[(N'-cyanocarbamimidoyl)-methylamino]ethylsulfanyl]-3-oxobutan-2-yl] acetate Traditional Name: acetic acid [1-[[2-[(N'-cyanoamidino)-methyl-amino]ethylthio]methyl]-2-keto-propyl] ester Formula: C11H18N4O3S MolecularWeight: 286.35062

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(CSCCN(C)C(=NC#N)N)OC(=O)C

Isomeric SMILES

CC(=O)C(CSCCN(C)C(=NC#N)N)OC(=O)C

InChI

InChI=1S/C11H18N4O3S/c1-8(16)10(18-9(2)17)6-19-5-4-15(3)11(13)14-7-12/h10H,4-6H2,1-3H3,(H2,13,14)