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

Systemtic Name: N-dodecyl-4-oxidanylidene-N-[5-(phenylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]butanamide Openeye Name: N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-N-dodecyl-4-oxo-butanamide CAS Name: N-dodecyl-4-oxo-N-[5-(phenylmethylthio)-1,3,4-thiadiazol-2-yl]butanamide IUPAC Name: N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-N-dodecyl-4-oxobutanamide Traditional Name: N-[5-(benzylthio)-1,3,4-thiadiazol-2-yl]-4-keto-N-lauryl-butyramide Formula: C25H37N3O2S2 MolecularWeight: 475.71018

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCN(C1=NN=C(S1)SCC2=CC=CC=C2)C(=O)CCC=O

Isomeric SMILES

CCCCCCCCCCCCN(C1=NN=C(S1)SCC2=CC=CC=C2)C(=O)CCC=O

InChI

InChI=1S/C25H37N3O2S2/c1-2-3-4-5-6-7-8-9-10-14-19-28(23(30)18-15-20-29)24-26-27-25(32-24)31-21-22-16-12-11-13-17-22/h11-13,16-17,20H,2-10,14-15,18-19,21H2,1H3