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[(E)-4-azanyl-3-cyano-2-oxidanylidene-pent-3-enyl] 2-[(4-acetamidophenyl)sulfonylamino]ethanoate

[(E)-4-azanyl-3-cyano-2-oxidanylidene-pent-3-enyl] 2-[(4-acetamidophenyl)sulfonylamino]ethanoate

Systemtic Name:[(E)-4-azanyl-3-cyano-2-oxidanylidene-pent-3-enyl] 2-[(4-acetamidophenyl)sulfonylamino]ethanoate
Openeye Name:[(E)-4-amino-3-cyano-2-oxo-pent-3-enyl] 2-[(4-acetamidophenyl)sulfonylamino]acetate
CAS Name:2-[(4-acetamidophenyl)sulfonylamino]acetic acid [(E)-4-amino-3-cyano-2-oxopent-3-enyl] ester
IUPAC Name:[(E)-4-amino-3-cyano-2-oxopent-3-enyl] 2-[(4-acetamidophenyl)sulfonylamino]acetate
Traditional Name:2-[(4-acetamidophenyl)sulfonylamino]acetic acid [(E)-4-amino-3-cyano-2-keto-pent-3-enyl] ester
Formula: C16H18N4O6S
MolecularWeight: 394.40232
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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(C#N)C(=O)COC(=O)CNS(=O)(=O)C1=CC=C(C=C1)NC(=O)C)N


Isomeric SMILES

C/C(=C(/C#N)\C(=O)COC(=O)CNS(=O)(=O)C1=CC=C(C=C1)NC(=O)C)/N


InChI

InChI=1S/C16H18N4O6S/c1-10(18)14(7-17)15(22)9-26-16(23)8-19-27(24,25)13-5-3-12(4-6-13)20-11(2)21/h3-6,19H,8-9,18H2,1-2H3,(H,20,21)/b14-10+


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