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4-[(E)-2-cyano-3-oxidanylidene-3-(1,3-thiazol-2-ylamino)prop-1-enyl]benzoic acid

4-[(E)-2-cyano-3-oxidanylidene-3-(1,3-thiazol-2-ylamino)prop-1-enyl]benzoic acid

Systemtic Name:4-[(E)-2-cyano-3-oxidanylidene-3-(1,3-thiazol-2-ylamino)prop-1-enyl]benzoic acid
Openeye Name:4-[(E)-2-cyano-3-oxo-3-(thiazol-2-ylamino)prop-1-enyl]benzoic acid
CAS Name:4-[(E)-2-cyano-3-oxo-3-(2-thiazolylamino)prop-1-enyl]benzoic acid
IUPAC Name:4-[(E)-2-cyano-3-oxo-3-(1,3-thiazol-2-ylamino)prop-1-enyl]benzoic acid
Traditional Name:4-[(E)-2-cyano-3-keto-3-(thiazol-2-ylamino)prop-1-enyl]benzoic acid
Formula: C14H9N3O3S
MolecularWeight: 299.30456
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=C(C#N)C(=O)NC2=NC=CS2)C(=O)O


Isomeric SMILES

C1=CC(=CC=C1/C=C(\C#N)/C(=O)NC2=NC=CS2)C(=O)O


InChI

InChI=1S/C14H9N3O3S/c15-8-11(12(18)17-14-16-5-6-21-14)7-9-1-3-10(4-2-9)13(19)20/h1-7H,(H,19,20)(H,16,17,18)/b11-7+


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