(E)-N-[3-[2-(1,3-benzodioxol-5-ylamino)-2-oxidanylidene-ethyl]sulfanylphenyl]-3-phenyl-prop-2-enamide

Systemtic Name: (E)-N-[3-[2-(1,3-benzodioxol-5-ylamino)-2-oxidanylidene-ethyl]sulfanylphenyl]-3-phenyl-prop-2-enamide Openeye Name: (E)-N-[3-[2-(1,3-benzodioxol-5-ylamino)-2-oxo-ethyl]sulfanylphenyl]-3-phenyl-prop-2-enamide CAS Name: (E)-N-[3-[[2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl]thio]phenyl]-3-phenyl-2-propenamide IUPAC Name: (E)-N-[3-[2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl]sulfanylphenyl]-3-phenylprop-2-enamide Traditional Name: (E)-N-[3-[[2-(1,3-benzodioxol-5-ylamino)-2-keto-ethyl]thio]phenyl]-3-phenyl-acrylamide Formula: C24H20N2O4S MolecularWeight: 432.4916

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)NC(=O)CSC3=CC=CC(=C3)NC(=O)C=CC4=CC=CC=C4

Isomeric SMILES

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

InChI

InChI=1S/C24H20N2O4S/c27-23(12-9-17-5-2-1-3-6-17)25-18-7-4-8-20(13-18)31-15-24(28)26-19-10-11-21-22(14-19)30-16-29-21/h1-14H,15-16H2,(H,25,27)(H,26,28)/b12-9+