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

Systemtic Name: 3,3-dimethyl-N-[5-[(phenylmethylsulfanyl)methyl]-1,3,4-thiadiazol-2-yl]butanamide Openeye Name: N-[5-(benzylsulfanylmethyl)-1,3,4-thiadiazol-2-yl]-3,3-dimethyl-butanamide CAS Name: 3,3-dimethyl-N-[5-[(phenylmethylthio)methyl]-1,3,4-thiadiazol-2-yl]butanamide IUPAC Name: N-[5-(benzylsulfanylmethyl)-1,3,4-thiadiazol-2-yl]-3,3-dimethylbutanamide Traditional Name: N-[5-[(benzylthio)methyl]-1,3,4-thiadiazol-2-yl]-3,3-dimethyl-butyramide Formula: C16H21N3OS2 MolecularWeight: 335.48744

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(=O)NC1=NN=C(S1)CSCC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)CC(=O)NC1=NN=C(S1)CSCC2=CC=CC=C2

InChI

InChI=1S/C16H21N3OS2/c1-16(2,3)9-13(20)17-15-19-18-14(22-15)11-21-10-12-7-5-4-6-8-12/h4-8H,9-11H2,1-3H3,(H,17,19,20)