(E)-3-(3-methoxy-4-phenylmethoxy-phenyl)-N-(5-propyl-1,3,4-thiadiazol-2-yl)prop-2-enamide

Systemtic Name: (E)-3-(3-methoxy-4-phenylmethoxy-phenyl)-N-(5-propyl-1,3,4-thiadiazol-2-yl)prop-2-enamide Openeye Name: (E)-3-(4-benzyloxy-3-methoxy-phenyl)-N-(5-propyl-1,3,4-thiadiazol-2-yl)prop-2-enamide CAS Name: (E)-3-(3-methoxy-4-phenylmethoxyphenyl)-N-(5-propyl-1,3,4-thiadiazol-2-yl)-2-propenamide IUPAC Name: (E)-3-(3-methoxy-4-phenylmethoxyphenyl)-N-(5-propyl-1,3,4-thiadiazol-2-yl)prop-2-enamide Traditional Name: (E)-3-(4-benzoxy-3-methoxy-phenyl)-N-(5-propyl-1,3,4-thiadiazol-2-yl)acrylamide Formula: C22H23N3O3S MolecularWeight: 409.50132

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN=C(S1)NC(=O)C=CC2=CC(=C(C=C2)OCC3=CC=CC=C3)OC

Isomeric SMILES

CCCC1=NN=C(S1)NC(=O)/C=C/C2=CC(=C(C=C2)OCC3=CC=CC=C3)OC

InChI

InChI=1S/C22H23N3O3S/c1-3-7-21-24-25-22(29-21)23-20(26)13-11-16-10-12-18(19(14-16)27-2)28-15-17-8-5-4-6-9-17/h4-6,8-14H,3,7,15H2,1-2H3,(H,23,25,26)/b13-11+