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

Systemtic Name: 4-(4-ethoxyphenyl)-4-oxidanylidene-N-[5-(phenylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]butanamide Openeye Name: N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-4-(4-ethoxyphenyl)-4-oxo-butanamide CAS Name: 4-(4-ethoxyphenyl)-4-oxo-N-[5-(phenylmethylthio)-1,3,4-thiadiazol-2-yl]butanamide IUPAC Name: N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-4-(4-ethoxyphenyl)-4-oxobutanamide Traditional Name: N-[5-(benzylthio)-1,3,4-thiadiazol-2-yl]-4-keto-4-p-phenetyl-butyramide Formula: C21H21N3O3S2 MolecularWeight: 427.53974

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)CCC(=O)NC2=NN=C(S2)SCC3=CC=CC=C3

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)CCC(=O)NC2=NN=C(S2)SCC3=CC=CC=C3

InChI

InChI=1S/C21H21N3O3S2/c1-2-27-17-10-8-16(9-11-17)18(25)12-13-19(26)22-20-23-24-21(29-20)28-14-15-6-4-3-5-7-15/h3-11H,2,12-14H2,1H3,(H,22,23,26)