3-methyl-N-[5-[2-oxidanylidene-2-(phenethylamino)ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]butanamide

Systemtic Name: 3-methyl-N-[5-[2-oxidanylidene-2-(phenethylamino)ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]butanamide Openeye Name: 3-methyl-N-[5-[2-oxo-2-(phenethylamino)ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]butanamide CAS Name: 3-methyl-N-[5-[[2-oxo-2-(phenethylamino)ethyl]thio]-1,3,4-thiadiazol-2-yl]butanamide IUPAC Name: 3-methyl-N-[5-[2-oxo-2-(phenethylamino)ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]butanamide Traditional Name: N-[5-[[2-keto-2-(phenethylamino)ethyl]thio]-1,3,4-thiadiazol-2-yl]-3-methyl-butyramide Formula: C17H22N4O2S2 MolecularWeight: 378.51218

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC1=NN=C(S1)SCC(=O)NCCC2=CC=CC=C2

Isomeric SMILES

CC(C)CC(=O)NC1=NN=C(S1)SCC(=O)NCCC2=CC=CC=C2

InChI

InChI=1S/C17H22N4O2S2/c1-12(2)10-14(22)19-16-20-21-17(25-16)24-11-15(23)18-9-8-13-6-4-3-5-7-13/h3-7,12H,8-11H2,1-2H3,(H,18,23)(H,19,20,22)