ethyl (E)-3-[[2-(2-azanyl-2-oxidanylidene-ethyl)sulfanylphenyl]amino]-2-cyano-prop-2-enoate

Systemtic Name: ethyl (E)-3-[[2-(2-azanyl-2-oxidanylidene-ethyl)sulfanylphenyl]amino]-2-cyano-prop-2-enoate Openeye Name: ethyl (E)-3-[2-(2-amino-2-oxo-ethyl)sulfanylanilino]-2-cyano-prop-2-enoate CAS Name: (E)-3-[2-[(2-amino-2-oxoethyl)thio]anilino]-2-cyano-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-[2-(2-amino-2-oxoethyl)sulfanylanilino]-2-cyanoprop-2-enoate Traditional Name: (E)-3-[2-[(2-amino-2-keto-ethyl)thio]anilino]-2-cyano-acrylic acid ethyl ester Formula: C14H15N3O3S MolecularWeight: 305.3522

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CNC1=CC=CC=C1SCC(=O)N)C#N

Isomeric SMILES

CCOC(=O)/C(=C/NC1=CC=CC=C1SCC(=O)N)/C#N

InChI

InChI=1S/C14H15N3O3S/c1-2-20-14(19)10(7-15)8-17-11-5-3-4-6-12(11)21-9-13(16)18/h3-6,8,17H,2,9H2,1H3,(H2,16,18)/b10-8+