2-cyano-1-ethoxy-3-[(phenylmethyl)amino]-3-sulfanylidene-prop-1-en-1-olate

Systemtic Name: 2-cyano-1-ethoxy-3-[(phenylmethyl)amino]-3-sulfanylidene-prop-1-en-1-olate Openeye Name: 3-(benzylamino)-2-cyano-1-ethoxy-3-thioxo-prop-1-en-1-olate CAS Name: 2-cyano-1-ethoxy-3-[(phenylmethyl)amino]-3-sulfanylidene-1-propen-1-olate IUPAC Name: 3-(benzylamino)-2-cyano-1-ethoxy-3-sulfanylideneprop-1-en-1-olate Traditional Name: 3-(benzylamino)-2-cyano-1-ethoxy-3-thioxo-prop-1-en-1-olate Formula: C13H13N2O2S- MolecularWeight: 261.31952

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=C(C#N)C(=S)NCC1=CC=CC=C1)[O-]

Isomeric SMILES

CCOC(=C(C#N)C(=S)NCC1=CC=CC=C1)[O-]

InChI

InChI=1S/C13H14N2O2S/c1-2-17-13(16)11(8-14)12(18)15-9-10-6-4-3-5-7-10/h3-7,16H,2,9H2,1H3,(H,15,18)/p-1