(E)-3-[ethanoyl(2-oxidanylsulfanylethyl)amino]-N-phenyl-but-2-enamide

Systemtic Name: (E)-3-[ethanoyl(2-oxidanylsulfanylethyl)amino]-N-phenyl-but-2-enamide Openeye Name: (E)-3-[acetyl(2-hydroxysulfanylethyl)amino]-N-phenyl-but-2-enamide CAS Name: 2-[acetyl-[(E)-4-anilino-4-oxobut-2-en-2-yl]amino]ethanesulfenic acid IUPAC Name: (E)-3-[acetyl(2-hydroxysulfanylethyl)amino]-N-phenylbut-2-enamide Traditional Name: (E)-3-[acetyl(2-sulfenoethyl)amino]-N-phenyl-but-2-enamide Formula: C14H18N2O3S MolecularWeight: 294.36932

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)NC1=CC=CC=C1)N(CCSO)C(=O)C

Isomeric SMILES

C/C(=C\C(=O)NC1=CC=CC=C1)/N(CCSO)C(=O)C

InChI

InChI=1S/C14H18N2O3S/c1-11(16(12(2)17)8-9-20-19)10-14(18)15-13-6-4-3-5-7-13/h3-7,10,19H,8-9H2,1-2H3,(H,15,18)/b11-10+