methyl 6-[[(Z)-1-(4-bromophenyl)propylideneamino]carbamothioylamino]hexanoate

Systemtic Name: methyl 6-[[(Z)-1-(4-bromophenyl)propylideneamino]carbamothioylamino]hexanoate Openeye Name: methyl 6-[[(Z)-1-(4-bromophenyl)propylideneamino]carbamothioylamino]hexanoate CAS Name: 6-[[[(2Z)-2-[1-(4-bromophenyl)propylidene]hydrazinyl]-sulfanylidenemethyl]amino]hexanoic acid methyl ester IUPAC Name: methyl 6-[[(Z)-1-(4-bromophenyl)propylideneamino]carbamothioylamino]hexanoate Traditional Name: 6-[[(Z)-1-(4-bromophenyl)propylideneamino]thiocarbamoylamino]hexanoic acid methyl ester Formula: C17H24BrN3O2S MolecularWeight: 414.36036

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=NNC(=S)NCCCCCC(=O)OC)C1=CC=C(C=C1)Br

Isomeric SMILES

CC/C(=N/NC(=S)NCCCCCC(=O)OC)/C1=CC=C(C=C1)Br

InChI

InChI=1S/C17H24BrN3O2S/c1-3-15(13-8-10-14(18)11-9-13)20-21-17(24)19-12-6-4-5-7-16(22)23-2/h8-11H,3-7,12H2,1-2H3,(H2,19,21,24)/b20-15-