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

Systemtic Name: (E)-3-(1,3-benzodioxol-5-yl)-N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)prop-2-enamide Openeye Name: (E)-3-(1,3-benzodioxol-5-yl)-N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)prop-2-enamide CAS Name: (E)-3-(1,3-benzodioxol-5-yl)-N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-2-propenamide IUPAC Name: (E)-3-(1,3-benzodioxol-5-yl)-N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)prop-2-enamide Traditional Name: (E)-3-(1,3-benzodioxol-5-yl)-N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)acrylamide Formula: C16H17N3O3S MolecularWeight: 331.38948

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H17N3O3S/c1-16(2,3)14-18-19-15(23-14)17-13(20)7-5-10-4-6-11-12(8-10)22-9-21-11/h4-8H,9H2,1-3H3,(H,17,19,20)/b7-5+