1-(6-azido-8-pyridin-2-yl-7-sulfanylidene-octyl)-3-(2-pyridin-2-ylethanethioyl)azetidin-2-one

Systemtic Name: 1-(6-azido-8-pyridin-2-yl-7-sulfanylidene-octyl)-3-(2-pyridin-2-ylethanethioyl)azetidin-2-one Openeye Name: 1-[6-azido-8-(2-pyridyl)-7-thioxo-octyl]-3-[2-(2-pyridyl)ethanethioyl]azetidin-2-one CAS Name: 1-[6-azido-8-(2-pyridinyl)-7-sulfanylideneoctyl]-3-[2-(2-pyridinyl)-1-sulfanylideneethyl]-2-azetidinone IUPAC Name: 1-(6-azido-8-pyridin-2-yl-7-sulfanylideneoctyl)-3-(2-pyridin-2-ylethanethioyl)azetidin-2-one Traditional Name: 1-[6-azido-8-(2-pyridyl)-7-thioxo-octyl]-3-[2-(2-pyridyl)thioacetyl]azetidin-2-one Formula: C23H26N6OS2 MolecularWeight: 466.62214

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(=O)N1CCCCCC(C(=S)CC2=CC=CC=N2)N=[N+]=[N-])C(=S)CC3=CC=CC=N3

Isomeric SMILES

C1C(C(=O)N1CCCCCC(C(=S)CC2=CC=CC=N2)N=[N+]=[N-])C(=S)CC3=CC=CC=N3

InChI

InChI=1S/C23H26N6OS2/c24-28-27-20(22(32)15-18-9-4-6-12-26-18)10-2-1-7-13-29-16-19(23(29)30)21(31)14-17-8-3-5-11-25-17/h3-6,8-9,11-12,19-20H,1-2,7,10,13-16H2