1-(azepan-1-yl)-3-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]propan-1-one

Systemtic Name: 1-(azepan-1-yl)-3-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]propan-1-one Openeye Name: 1-(azepan-1-yl)-3-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]propan-1-one CAS Name: 1-(1-azepanyl)-3-[(5-methyl-1,3,4-thiadiazol-2-yl)thio]-1-propanone IUPAC Name: 1-(azepan-1-yl)-3-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]propan-1-one Traditional Name: 1-(azepan-1-yl)-3-[(5-methyl-1,3,4-thiadiazol-2-yl)thio]propan-1-one Formula: C12H19N3OS2 MolecularWeight: 285.42876

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(S1)SCCC(=O)N2CCCCCC2

Isomeric SMILES

CC1=NN=C(S1)SCCC(=O)N2CCCCCC2

InChI

InChI=1S/C12H19N3OS2/c1-10-13-14-12(18-10)17-9-6-11(16)15-7-4-2-3-5-8-15/h2-9H2,1H3