(phenylmethyl) N-[3-(ethyldisulfanyl)-1-oxidanylidene-1-piperazin-1-yl-propan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[3-(ethyldisulfanyl)-1-oxidanylidene-1-piperazin-1-yl-propan-2-yl]carbamate Openeye Name: benzyl N-[1-[(ethyldisulfanyl)methyl]-2-oxo-2-piperazin-1-yl-ethyl]carbamate CAS Name: N-[3-(ethyldisulfanyl)-1-oxo-1-(1-piperazinyl)propan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[3-(ethyldisulfanyl)-1-oxo-1-piperazin-1-ylpropan-2-yl]carbamate Traditional Name: N-[1-[(ethyldisulfanyl)methyl]-2-keto-2-piperazino-ethyl]carbamic acid benzyl ester Formula: C17H25N3O3S2 MolecularWeight: 383.5287

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Descriptors Computed from Structure

Canonical SMILES:

CCSSCC(C(=O)N1CCNCC1)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CCSSCC(C(=O)N1CCNCC1)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C17H25N3O3S2/c1-2-24-25-13-15(16(21)20-10-8-18-9-11-20)19-17(22)23-12-14-6-4-3-5-7-14/h3-7,15,18H,2,8-13H2,1H3,(H,19,22)