5-chloranyl-4-[(3-chloranyl-5-oxidanylidene-1,2-dithiol-4-yl)-(phenylmethyl)amino]-1,2-dithiol-3-one

Systemtic Name: 5-chloranyl-4-[(3-chloranyl-5-oxidanylidene-1,2-dithiol-4-yl)-(phenylmethyl)amino]-1,2-dithiol-3-one Openeye Name: 4-[benzyl-(3-chloro-5-oxo-dithiol-4-yl)amino]-5-chloro-dithiol-3-one CAS Name: 5-chloro-4-[(3-chloro-5-oxo-4-dithiolyl)-(phenylmethyl)amino]-3-dithiolone IUPAC Name: 4-[benzyl-(3-chloro-5-oxodithiol-4-yl)amino]-5-chlorodithiol-3-one Traditional Name: 4-[benzyl-(3-chloro-5-keto-dithiol-4-yl)amino]-5-chloro-dithiol-3-one Formula: C13H7Cl2NO2S4 MolecularWeight: 408.36618

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(C2=C(SSC2=O)Cl)C3=C(SSC3=O)Cl

Isomeric SMILES

C1=CC=C(C=C1)CN(C2=C(SSC2=O)Cl)C3=C(SSC3=O)Cl

InChI

InChI=1S/C13H7Cl2NO2S4/c14-10-8(12(17)21-19-10)16(6-7-4-2-1-3-5-7)9-11(15)20-22-13(9)18/h1-5H,6H2