[2,5-bis(oxidanylidene)pyrrolidin-1-yl] 3-methylsulfanyl-2-(phenylmethoxycarbonylamino)propanoate

Systemtic Name: [2,5-bis(oxidanylidene)pyrrolidin-1-yl] 3-methylsulfanyl-2-(phenylmethoxycarbonylamino)propanoate Openeye Name: (2,5-dioxopyrrolidin-1-yl) 2-(benzyloxycarbonylamino)-3-methylsulfanyl-propanoate CAS Name: 3-(methylthio)-2-(phenylmethoxycarbonylamino)propanoic acid (2,5-dioxo-1-pyrrolidinyl) ester IUPAC Name: (2,5-dioxopyrrolidin-1-yl) 3-methylsulfanyl-2-(phenylmethoxycarbonylamino)propanoate Traditional Name: 2-(benzyloxycarbonylamino)-3-(methylthio)propionic acid succinimido ester Formula: C16H18N2O6S MolecularWeight: 366.38892

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Descriptors Computed from Structure

Canonical SMILES:

CSCC(C(=O)ON1C(=O)CCC1=O)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CSCC(C(=O)ON1C(=O)CCC1=O)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C16H18N2O6S/c1-25-10-12(15(21)24-18-13(19)7-8-14(18)20)17-16(22)23-9-11-5-3-2-4-6-11/h2-6,12H,7-10H2,1H3,(H,17,22)