(E)-N-[2-[1,3-benzodioxol-5-ylmethyl(thiophen-2-ylmethyl)amino]-2-oxidanylidene-ethyl]-3-phenyl-N-prop-2-enyl-prop-2-enamide

Systemtic Name: (E)-N-[2-[1,3-benzodioxol-5-ylmethyl(thiophen-2-ylmethyl)amino]-2-oxidanylidene-ethyl]-3-phenyl-N-prop-2-enyl-prop-2-enamide Openeye Name: (E)-N-allyl-N-[2-[1,3-benzodioxol-5-ylmethyl(2-thienylmethyl)amino]-2-oxo-ethyl]-3-phenyl-prop-2-enamide CAS Name: (E)-N-[2-[1,3-benzodioxol-5-ylmethyl(thiophen-2-ylmethyl)amino]-2-oxoethyl]-3-phenyl-N-prop-2-enyl-2-propenamide IUPAC Name: (E)-N-[2-[1,3-benzodioxol-5-ylmethyl(thiophen-2-ylmethyl)amino]-2-oxoethyl]-3-phenyl-N-prop-2-enylprop-2-enamide Traditional Name: (E)-N-allyl-N-[2-keto-2-[piperonyl(2-thenyl)amino]ethyl]-3-phenyl-acrylamide Formula: C27H26N2O4S MolecularWeight: 474.57134

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN(CC(=O)N(CC1=CC2=C(C=C1)OCO2)CC3=CC=CS3)C(=O)C=CC4=CC=CC=C4

Isomeric SMILES

C=CCN(CC(=O)N(CC1=CC2=C(C=C1)OCO2)CC3=CC=CS3)C(=O)/C=C/C4=CC=CC=C4

InChI

InChI=1S/C27H26N2O4S/c1-2-14-28(26(30)13-11-21-7-4-3-5-8-21)19-27(31)29(18-23-9-6-15-34-23)17-22-10-12-24-25(16-22)33-20-32-24/h2-13,15-16H,1,14,17-20H2/b13-11+