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

Systemtic Name: N-[4-[2-(1,3-benzodioxol-5-ylamino)-2-oxidanylidene-ethyl]sulfanylphenyl]naphthalene-2-carboxamide Openeye Name: N-[4-[2-(1,3-benzodioxol-5-ylamino)-2-oxo-ethyl]sulfanylphenyl]naphthalene-2-carboxamide CAS Name: N-[4-[[2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl]thio]phenyl]-2-naphthalenecarboxamide IUPAC Name: N-[4-[2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl]sulfanylphenyl]naphthalene-2-carboxamide Traditional Name: N-[4-[[2-(1,3-benzodioxol-5-ylamino)-2-keto-ethyl]thio]phenyl]-2-naphthamide Formula: C26H20N2O4S MolecularWeight: 456.513

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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=CC5=CC=CC=C5C=C4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)NC(=O)CSC3=CC=C(C=C3)NC(=O)C4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C26H20N2O4S/c29-25(27-21-9-12-23-24(14-21)32-16-31-23)15-33-22-10-7-20(8-11-22)28-26(30)19-6-5-17-3-1-2-4-18(17)13-19/h1-14H,15-16H2,(H,27,29)(H,28,30)