5-[(4-chloranylpyrazol-1-yl)methyl]-N-[(4-iodanyl-2-methyl-phenyl)carbamothioyl]furan-2-carboxamide

Systemtic Name: 5-[(4-chloranylpyrazol-1-yl)methyl]-N-[(4-iodanyl-2-methyl-phenyl)carbamothioyl]furan-2-carboxamide Openeye Name: 5-[(4-chloropyrazol-1-yl)methyl]-N-[(4-iodo-2-methyl-phenyl)carbamothioyl]furan-2-carboxamide CAS Name: 5-[(4-chloro-1-pyrazolyl)methyl]-N-[(4-iodo-2-methylanilino)-sulfanylidenemethyl]-2-furancarboxamide IUPAC Name: 5-[(4-chloropyrazol-1-yl)methyl]-N-[(4-iodo-2-methylphenyl)carbamothioyl]furan-2-carboxamide Traditional Name: 5-[(4-chloropyrazol-1-yl)methyl]-N-[(4-iodo-2-methyl-phenyl)thiocarbamoyl]-2-furamide Formula: C17H14ClIN4O2S MolecularWeight: 500.74113

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)I)NC(=S)NC(=O)C2=CC=C(O2)CN3C=C(C=N3)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)I)NC(=S)NC(=O)C2=CC=C(O2)CN3C=C(C=N3)Cl

InChI

InChI=1S/C17H14ClIN4O2S/c1-10-6-12(19)2-4-14(10)21-17(26)22-16(24)15-5-3-13(25-15)9-23-8-11(18)7-20-23/h2-8H,9H2,1H3,(H2,21,22,24,26)