1-(azepan-1-yl)-2-[(5-phenyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethanone

Systemtic Name: 1-(azepan-1-yl)-2-[(5-phenyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethanone Openeye Name: 1-(azepan-1-yl)-2-[(5-phenyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethanone CAS Name: 1-(1-azepanyl)-2-[(5-phenyl-1,3,4-thiadiazol-2-yl)thio]ethanone IUPAC Name: 1-(azepan-1-yl)-2-[(5-phenyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethanone Traditional Name: 1-(azepan-1-yl)-2-[(5-phenyl-1,3,4-thiadiazol-2-yl)thio]ethanone Formula: C16H19N3OS2 MolecularWeight: 333.47156

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)CSC2=NN=C(S2)C3=CC=CC=C3

Isomeric SMILES

C1CCCN(CC1)C(=O)CSC2=NN=C(S2)C3=CC=CC=C3

InChI

InChI=1S/C16H19N3OS2/c20-14(19-10-6-1-2-7-11-19)12-21-16-18-17-15(22-16)13-8-4-3-5-9-13/h3-5,8-9H,1-2,6-7,10-12H2