1-azanyl-2-cyano-3-(3-methoxypropylamino)-3-sulfanylidene-prop-1-en-1-olate

Systemtic Name: 1-azanyl-2-cyano-3-(3-methoxypropylamino)-3-sulfanylidene-prop-1-en-1-olate Openeye Name: 1-amino-2-cyano-3-(3-methoxypropylamino)-3-thioxo-prop-1-en-1-olate CAS Name: 1-amino-2-cyano-3-(3-methoxypropylamino)-3-sulfanylidene-1-propen-1-olate IUPAC Name: 1-amino-2-cyano-3-(3-methoxypropylamino)-3-sulfanylideneprop-1-en-1-olate Traditional Name: 1-amino-2-cyano-3-(3-methoxypropylamino)-3-thioxo-prop-1-en-1-olate Formula: C8H12N3O2S- MolecularWeight: 214.26478

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Descriptors Computed from Structure

Canonical SMILES:

COCCCNC(=S)C(=C(N)[O-])C#N

Isomeric SMILES

COCCCNC(=S)C(=C(N)[O-])C#N

InChI

InChI=1S/C8H13N3O2S/c1-13-4-2-3-11-8(14)6(5-9)7(10)12/h12H,2-4,10H2,1H3,(H,11,14)/p-1