(E)-3-(1,3-benzodioxol-5-yl)-N-[2-(thiophen-3-ylmethylsulfanyl)phenyl]prop-2-enamide

Systemtic Name: (E)-3-(1,3-benzodioxol-5-yl)-N-[2-(thiophen-3-ylmethylsulfanyl)phenyl]prop-2-enamide Openeye Name: (E)-3-(1,3-benzodioxol-5-yl)-N-[2-(3-thienylmethylsulfanyl)phenyl]prop-2-enamide CAS Name: (E)-3-(1,3-benzodioxol-5-yl)-N-[2-(3-thiophenylmethylthio)phenyl]-2-propenamide IUPAC Name: (E)-3-(1,3-benzodioxol-5-yl)-N-[2-(thiophen-3-ylmethylsulfanyl)phenyl]prop-2-enamide Traditional Name: (E)-3-(1,3-benzodioxol-5-yl)-N-[2-(3-thenylthio)phenyl]acrylamide Formula: C21H17NO3S2 MolecularWeight: 395.49458

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C=CC(=O)NC3=CC=CC=C3SCC4=CSC=C4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)/C=C/C(=O)NC3=CC=CC=C3SCC4=CSC=C4

InChI

InChI=1S/C21H17NO3S2/c23-21(8-6-15-5-7-18-19(11-15)25-14-24-18)22-17-3-1-2-4-20(17)27-13-16-9-10-26-12-16/h1-12H,13-14H2,(H,22,23)/b8-6+