4-(2-ethoxyphenoxy)-N-[5-(phenylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]butanamide

Systemtic Name: 4-(2-ethoxyphenoxy)-N-[5-(phenylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]butanamide Openeye Name: N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-4-(2-ethoxyphenoxy)butanamide CAS Name: 4-(2-ethoxyphenoxy)-N-[5-(phenylmethylthio)-1,3,4-thiadiazol-2-yl]butanamide IUPAC Name: N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-4-(2-ethoxyphenoxy)butanamide Traditional Name: N-[5-(benzylthio)-1,3,4-thiadiazol-2-yl]-4-(2-ethoxyphenoxy)butyramide Formula: C21H23N3O3S2 MolecularWeight: 429.55562

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1OCCCC(=O)NC2=NN=C(S2)SCC3=CC=CC=C3

Isomeric SMILES

CCOC1=CC=CC=C1OCCCC(=O)NC2=NN=C(S2)SCC3=CC=CC=C3

InChI

InChI=1S/C21H23N3O3S2/c1-2-26-17-11-6-7-12-18(17)27-14-8-13-19(25)22-20-23-24-21(29-20)28-15-16-9-4-3-5-10-16/h3-7,9-12H,2,8,13-15H2,1H3,(H,22,23,25)