ethyl 4-(N-cyano-N'-prop-2-enyl-carbamimidoyl)sulfanyl-3-oxidanylidene-butanoate

Systemtic Name: ethyl 4-(N-cyano-N'-prop-2-enyl-carbamimidoyl)sulfanyl-3-oxidanylidene-butanoate Openeye Name: ethyl 4-(N'-allyl-N-cyano-carbamimidoyl)sulfanyl-3-oxo-butanoate CAS Name: 4-[[(cyanoamino)-prop-2-enyliminomethyl]thio]-3-oxobutanoic acid ethyl ester IUPAC Name: ethyl 4-(N-cyano-N'-prop-2-enylcarbamimidoyl)sulfanyl-3-oxobutanoate Traditional Name: 4-[(N'-allyl-N-cyano-amidino)thio]-3-keto-butyric acid ethyl ester Formula: C11H15N3O3S MolecularWeight: 269.3201

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H15N3O3S/c1-3-5-13-11(14-8-12)18-7-9(15)6-10(16)17-4-2/h3H,1,4-7H2,2H3,(H,13,14)