(phenylmethyl) N-[3-[4-(butanethioylamino)butyl]oxiran-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[3-[4-(butanethioylamino)butyl]oxiran-2-yl]carbamate Openeye Name: benzyl N-[3-[4-(butanethioylamino)butyl]oxiran-2-yl]carbamate CAS Name: N-[3-[4-(1-sulfanylidenebutylamino)butyl]-2-oxiranyl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[3-[4-(butanethioylamino)butyl]oxiran-2-yl]carbamate Traditional Name: N-[3-[4-(butanethioylamino)butyl]oxiran-2-yl]carbamic acid benzyl ester Formula: C18H26N2O3S MolecularWeight: 350.47564

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(=S)NCCCCC1C(O1)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CCCC(=S)NCCCCC1C(O1)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C18H26N2O3S/c1-2-8-16(24)19-12-7-6-11-15-17(23-15)20-18(21)22-13-14-9-4-3-5-10-14/h3-5,9-10,15,17H,2,6-8,11-13H2,1H3,(H,19,24)(H,20,21)