ethyl (E)-2-cyano-3-[(E)-4-[(5-methyl-1,2-oxazol-3-yl)amino]-4-oxidanylidene-but-2-enoyl]sulfanyl-3-phenylazanyl-prop-2-enoate

Systemtic Name: ethyl (E)-2-cyano-3-[(E)-4-[(5-methyl-1,2-oxazol-3-yl)amino]-4-oxidanylidene-but-2-enoyl]sulfanyl-3-phenylazanyl-prop-2-enoate Openeye Name: ethyl (E)-3-anilino-2-cyano-3-[(E)-4-[(5-methylisoxazol-3-yl)amino]-4-oxo-but-2-enoyl]sulfanyl-prop-2-enoate CAS Name: (E)-3-anilino-2-cyano-3-[[(E)-4-[(5-methyl-3-isoxazolyl)amino]-1,4-dioxobut-2-enyl]thio]-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-anilino-2-cyano-3-[(E)-4-[(5-methyl-1,2-oxazol-3-yl)amino]-4-oxobut-2-enoyl]sulfanylprop-2-enoate Traditional Name: (E)-3-anilino-2-cyano-3-[[(E)-4-keto-4-[(5-methylisoxazol-3-yl)amino]but-2-enoyl]thio]acrylic acid ethyl ester Formula: C20H18N4O5S MolecularWeight: 426.44572

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=C(NC1=CC=CC=C1)SC(=O)C=CC(=O)NC2=NOC(=C2)C)C#N

Isomeric SMILES

CCOC(=O)/C(=C(\NC1=CC=CC=C1)/SC(=O)/C=C/C(=O)NC2=NOC(=C2)C)/C#N

InChI

InChI=1S/C20H18N4O5S/c1-3-28-20(27)15(12-21)19(22-14-7-5-4-6-8-14)30-18(26)10-9-17(25)23-16-11-13(2)29-24-16/h4-11,22H,3H2,1-2H3,(H,23,24,25)/b10-9+,19-15+