2-[[(3Z)-5-[(3-bromanylpyridin-2-yl)methylsulfanyl]-3-(nitromethylidene)pentyl]sulfanylmethyl]-3-methoxy-pyridine

Systemtic Name: 2-[[(3Z)-5-[(3-bromanylpyridin-2-yl)methylsulfanyl]-3-(nitromethylidene)pentyl]sulfanylmethyl]-3-methoxy-pyridine Openeye Name: 2-[[(3Z)-5-[(3-bromo-2-pyridyl)methylsulfanyl]-3-(nitromethylene)pentyl]sulfanylmethyl]-3-methoxy-pyridine CAS Name: 2-[[[(3Z)-5-[(3-bromo-2-pyridinyl)methylthio]-3-(nitromethylidene)pentyl]thio]methyl]-3-methoxypyridine IUPAC Name: 2-[[(3Z)-5-[(3-bromopyridin-2-yl)methylsulfanyl]-3-(nitromethylidene)pentyl]sulfanylmethyl]-3-methoxypyridine Traditional Name: 2-[[[(Z)-3-[2-[(3-bromo-2-pyridyl)methylthio]ethyl]-4-nitro-but-3-enyl]thio]methyl]-3-methoxy-pyridine Formula: C19H22BrN3O3S2 MolecularWeight: 484.43028

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(N=CC=C1)CSCCC(=C[N+](=O)[O-])CCSCC2=C(C=CC=N2)Br

Isomeric SMILES

COC1=C(N=CC=C1)CSCC/C(=C/[N+](=O)[O-])/CCSCC2=C(C=CC=N2)Br

InChI

InChI=1S/C19H22BrN3O3S2/c1-26-19-5-3-9-22-18(19)14-28-11-7-15(12-23(24)25)6-10-27-13-17-16(20)4-2-8-21-17/h2-5,8-9,12H,6-7,10-11,13-14H2,1H3/b15-12+