5-[4-[(Z)-N-(ethylcarbamothioylamino)-C-methyl-carbonimidoyl]phenyl]furan-2-carboxylic acid

Systemtic Name: 5-[4-[(Z)-N-(ethylcarbamothioylamino)-C-methyl-carbonimidoyl]phenyl]furan-2-carboxylic acid Openeye Name: 5-[4-[(Z)-N-(ethylcarbamothioylamino)-C-methyl-carbonimidoyl]phenyl]furan-2-carboxylic acid CAS Name: 5-[4-[(1Z)-1-[[ethylamino(sulfanylidene)methyl]hydrazinylidene]ethyl]phenyl]-2-furancarboxylic acid IUPAC Name: 5-[4-[(Z)-N-(ethylcarbamothioylamino)-C-methylcarbonimidoyl]phenyl]furan-2-carboxylic acid Traditional Name: 5-[4-[(Z)-N-(ethylthiocarbamoylamino)-C-methyl-carbonimidoyl]phenyl]-2-furoic acid Formula: C16H17N3O3S MolecularWeight: 331.38948

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)NN=C(C)C1=CC=C(C=C1)C2=CC=C(O2)C(=O)O

Isomeric SMILES

CCNC(=S)N/N=C(/C)\C1=CC=C(C=C1)C2=CC=C(O2)C(=O)O

InChI

InChI=1S/C16H17N3O3S/c1-3-17-16(23)19-18-10(2)11-4-6-12(7-5-11)13-8-9-14(22-13)15(20)21/h4-9H,3H2,1-2H3,(H,20,21)(H2,17,19,23)/b18-10-