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

Systemtic Name: (E)-3-(4-phenylmethoxyphenyl)-N-(5-propyl-1,3,4-thiadiazol-2-yl)prop-2-enamide Openeye Name: (E)-3-(4-benzyloxyphenyl)-N-(5-propyl-1,3,4-thiadiazol-2-yl)prop-2-enamide CAS Name: (E)-3-(4-phenylmethoxyphenyl)-N-(5-propyl-1,3,4-thiadiazol-2-yl)-2-propenamide IUPAC Name: (E)-3-(4-phenylmethoxyphenyl)-N-(5-propyl-1,3,4-thiadiazol-2-yl)prop-2-enamide Traditional Name: (E)-3-(4-benzoxyphenyl)-N-(5-propyl-1,3,4-thiadiazol-2-yl)acrylamide Formula: C21H21N3O2S MolecularWeight: 379.47534

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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

Isomeric SMILES

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

InChI

InChI=1S/C21H21N3O2S/c1-2-6-20-23-24-21(27-20)22-19(25)14-11-16-9-12-18(13-10-16)26-15-17-7-4-3-5-8-17/h3-5,7-14H,2,6,15H2,1H3,(H,22,24,25)/b14-11+