ethyl N-[(E)-2-cyano-3-[(5-iodanylpyridin-2-yl)amino]prop-2-enoyl]carbamate

Systemtic Name: ethyl N-[(E)-2-cyano-3-[(5-iodanylpyridin-2-yl)amino]prop-2-enoyl]carbamate Openeye Name: ethyl N-[(E)-2-cyano-3-[(5-iodo-2-pyridyl)amino]prop-2-enoyl]carbamate CAS Name: N-[(E)-2-cyano-3-[(5-iodo-2-pyridinyl)amino]-1-oxoprop-2-enyl]carbamic acid ethyl ester IUPAC Name: ethyl N-[(E)-2-cyano-3-[(5-iodopyridin-2-yl)amino]prop-2-enoyl]carbamate Traditional Name: N-[(E)-2-cyano-3-[(5-iodo-2-pyridyl)amino]acryloyl]carbamic acid ethyl ester Formula: C12H11IN4O3 MolecularWeight: 386.14521

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC(=O)C(=CNC1=NC=C(C=C1)I)C#N

Isomeric SMILES

CCOC(=O)NC(=O)/C(=C/NC1=NC=C(C=C1)I)/C#N

InChI

InChI=1S/C12H11IN4O3/c1-2-20-12(19)17-11(18)8(5-14)6-15-10-4-3-9(13)7-16-10/h3-4,6-7H,2H2,1H3,(H,15,16)(H,17,18,19)/b8-6+