2-[(5-azanyl-1,3,4-thiadiazol-2-yl)sulfanyl]-1-(4-butylphenyl)ethanone

Systemtic Name: 2-[(5-azanyl-1,3,4-thiadiazol-2-yl)sulfanyl]-1-(4-butylphenyl)ethanone Openeye Name: 2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]-1-(4-butylphenyl)ethanone CAS Name: 2-[(5-amino-1,3,4-thiadiazol-2-yl)thio]-1-(4-butylphenyl)ethanone IUPAC Name: 2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]-1-(4-butylphenyl)ethanone Traditional Name: 2-[(5-amino-1,3,4-thiadiazol-2-yl)thio]-1-(4-butylphenyl)ethanone Formula: C14H17N3OS2 MolecularWeight: 307.43428

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C(=O)CSC2=NN=C(S2)N

Isomeric SMILES

CCCCC1=CC=C(C=C1)C(=O)CSC2=NN=C(S2)N

InChI

InChI=1S/C14H17N3OS2/c1-2-3-4-10-5-7-11(8-6-10)12(18)9-19-14-17-16-13(15)20-14/h5-8H,2-4,9H2,1H3,(H2,15,16)