3-azanylidene-2-[1,4-bis(methylsulfanyl)-6,7-dihydro-5H-cyclopenta[d]pyridazin-3-ium-3-yl]prop-2-enenitrile

Systemtic Name: 3-azanylidene-2-[1,4-bis(methylsulfanyl)-6,7-dihydro-5H-cyclopenta[d]pyridazin-3-ium-3-yl]prop-2-enenitrile Openeye Name: 2-[1,4-bis(methylsulfanyl)-6,7-dihydro-5H-cyclopenta[d]pyridazin-3-ium-3-yl]-3-imino-prop-2-enenitrile CAS Name: 2-[1,4-bis(methylthio)-6,7-dihydro-5H-cyclopenta[d]pyridazin-3-ium-3-yl]-3-imino-2-propenenitrile IUPAC Name: 2-[1,4-bis(methylsulfanyl)-6,7-dihydro-5H-cyclopenta[d]pyridazin-3-ium-3-yl]-3-iminoprop-2-enenitrile Traditional Name: 2-[1,4-bis(methylthio)-6,7-dihydro-5H-cyclopenta[d]pyridazin-3-ium-3-yl]-3-imino-acrylonitrile Formula: C12H13N4S2+ MolecularWeight: 277.38842

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=N[N+](=C(C2=C1CCC2)SC)C(=C=N)C#N

Isomeric SMILES

CSC1=N[N+](=C(C2=C1CCC2)SC)C(=C=N)C#N

InChI

InChI=1S/C12H13N4S2/c1-17-11-9-4-3-5-10(9)12(18-2)16(15-11)8(6-13)7-14/h13H,3-5H2,1-2H3/q+1