(E)-3-(1,3-benzodioxol-5-yl)-N-(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)prop-2-enamide

Systemtic Name: (E)-3-(1,3-benzodioxol-5-yl)-N-(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)prop-2-enamide Openeye Name: (E)-3-(1,3-benzodioxol-5-yl)-N-[5-(1-ethylpropyl)-1,3,4-thiadiazol-2-yl]prop-2-enamide CAS Name: (E)-3-(1,3-benzodioxol-5-yl)-N-(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)-2-propenamide IUPAC Name: (E)-3-(1,3-benzodioxol-5-yl)-N-(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)prop-2-enamide Traditional Name: (E)-3-(1,3-benzodioxol-5-yl)-N-[5-(1-ethylpropyl)-1,3,4-thiadiazol-2-yl]acrylamide Formula: C17H19N3O3S MolecularWeight: 345.41606

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C1=NN=C(S1)NC(=O)C=CC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CCC(CC)C1=NN=C(S1)NC(=O)/C=C/C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C17H19N3O3S/c1-3-12(4-2)16-19-20-17(24-16)18-15(21)8-6-11-5-7-13-14(9-11)23-10-22-13/h5-9,12H,3-4,10H2,1-2H3,(H,18,20,21)/b8-6+