2-isothiocyanato-5-[2-(4-isothiocyanatocyclohexa-2,4-dien-1-yl)ethyl]cyclohexa-1,3-diene

Systemtic Name: 2-isothiocyanato-5-[2-(4-isothiocyanatocyclohexa-2,4-dien-1-yl)ethyl]cyclohexa-1,3-diene Openeye Name: 2-isothiocyanato-5-[2-(4-isothiocyanatocyclohexa-2,4-dien-1-yl)ethyl]cyclohexa-1,3-diene CAS Name: 2-isothiocyanato-5-[2-(4-isothiocyanato-1-cyclohexa-2,4-dienyl)ethyl]cyclohexa-1,3-diene IUPAC Name: 2-isothiocyanato-5-[2-(4-isothiocyanatocyclohexa-2,4-dien-1-yl)ethyl]cyclohexa-1,3-diene Traditional Name: 2-isothiocyanato-5-[2-(4-isothiocyanatocyclohexa-2,4-dien-1-yl)ethyl]cyclohexa-1,3-diene Formula: C16H16N2S2 MolecularWeight: 300.44164

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Descriptors Computed from Structure

Canonical SMILES:

C1C=C(C=CC1CCC2CC=C(C=C2)N=C=S)N=C=S

Isomeric SMILES

C1C=C(C=CC1CCC2CC=C(C=C2)N=C=S)N=C=S

InChI

InChI=1S/C16H16N2S2/c19-11-17-15-7-3-13(4-8-15)1-2-14-5-9-16(10-6-14)18-12-20/h3,5,7-10,13-14H,1-2,4,6H2