ethyl 2-(N-cyano-N'-prop-2-enyl-carbamimidoyl)sulfanylethanoate

Systemtic Name: ethyl 2-(N-cyano-N'-prop-2-enyl-carbamimidoyl)sulfanylethanoate Openeye Name: ethyl 2-(N'-allyl-N-cyano-carbamimidoyl)sulfanylacetate CAS Name: 2-[[(cyanoamino)-prop-2-enyliminomethyl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-(N-cyano-N'-prop-2-enylcarbamimidoyl)sulfanylacetate Traditional Name: 2-[(N'-allyl-N-cyano-amidino)thio]acetic acid ethyl ester Formula: C9H13N3O2S MolecularWeight: 227.28342

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC(=NCC=C)NC#N

Isomeric SMILES

CCOC(=O)CSC(=NCC=C)NC#N

InChI

InChI=1S/C9H13N3O2S/c1-3-5-11-9(12-7-10)15-6-8(13)14-4-2/h3H,1,4-6H2,2H3,(H,11,12)