N-[4-[2-(1,3-benzodioxol-5-ylamino)-2-oxidanylidene-ethyl]sulfanylphenyl]furan-2-carboxamide

Systemtic Name: N-[4-[2-(1,3-benzodioxol-5-ylamino)-2-oxidanylidene-ethyl]sulfanylphenyl]furan-2-carboxamide Openeye Name: N-[4-[2-(1,3-benzodioxol-5-ylamino)-2-oxo-ethyl]sulfanylphenyl]furan-2-carboxamide CAS Name: N-[4-[[2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl]thio]phenyl]-2-furancarboxamide IUPAC Name: N-[4-[2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl]sulfanylphenyl]furan-2-carboxamide Traditional Name: N-[4-[[2-(1,3-benzodioxol-5-ylamino)-2-keto-ethyl]thio]phenyl]-2-furamide Formula: C20H16N2O5S MolecularWeight: 396.41644

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)NC(=O)CSC3=CC=C(C=C3)NC(=O)C4=CC=CO4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)NC(=O)CSC3=CC=C(C=C3)NC(=O)C4=CC=CO4

InChI

InChI=1S/C20H16N2O5S/c23-19(21-14-5-8-16-18(10-14)27-12-26-16)11-28-15-6-3-13(4-7-15)22-20(24)17-2-1-9-25-17/h1-10H,11-12H2,(H,21,23)(H,22,24)