4-(azepan-1-yl)-N-(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)-4-oxidanylidene-butanamide

Systemtic Name: 4-(azepan-1-yl)-N-(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)-4-oxidanylidene-butanamide Openeye Name: 4-(azepan-1-yl)-N-(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)-4-oxo-butanamide CAS Name: 4-(1-azepanyl)-N-[5-(methylthio)-1,3,4-thiadiazol-2-yl]-4-oxobutanamide IUPAC Name: 4-(azepan-1-yl)-N-(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)-4-oxobutanamide Traditional Name: 4-(azepan-1-yl)-4-keto-N-[5-(methylthio)-1,3,4-thiadiazol-2-yl]butyramide Formula: C13H20N4O2S2 MolecularWeight: 328.4535

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NN=C(S1)NC(=O)CCC(=O)N2CCCCCC2

Isomeric SMILES

CSC1=NN=C(S1)NC(=O)CCC(=O)N2CCCCCC2

InChI

InChI=1S/C13H20N4O2S2/c1-20-13-16-15-12(21-13)14-10(18)6-7-11(19)17-8-4-2-3-5-9-17/h2-9H2,1H3,(H,14,15,18)