disodium (Z)-2-cyano-3-[(4-methylphenyl)amino]-3-oxidanidyl-prop-2-enedithioate

Systemtic Name: disodium (Z)-2-cyano-3-[(4-methylphenyl)amino]-3-oxidanidyl-prop-2-enedithioate Openeye Name: disodium (Z)-2-cyano-3-(4-methylanilino)-3-oxido-prop-2-enedithioate CAS Name: disodium (Z)-2-cyano-3-(4-methylanilino)-3-oxido-2-propenedithioate IUPAC Name: disodium (Z)-2-cyano-3-(4-methylanilino)-3-oxidoprop-2-enedithioate Traditional Name: disodium (Z)-2-cyano-3-oxido-3-(p-toluidino)prop-2-enedithioate Formula: C11H8N2Na2OS2 MolecularWeight: 294.30356

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=C(C#N)C(=S)[S-])[O-].[Na+].[Na+]

Isomeric SMILES

CC1=CC=C(C=C1)N/C(=C(\C#N)/C(=S)[S-])/[O-].[Na+].[Na+]

InChI

InChI=1S/C11H10N2OS2.2Na/c1-7-2-4-8(5-3-7)13-10(14)9(6-12)11(15)16;;/h2-5,13-14H,1H3,(H,15,16);;/q;2*+1/p-2/b10-9-;;