1-[2-oxidanyl-3-propyl-4-[3-[(1-sulfanylidene-1,3,4-thiadiazol-2-yl)sulfanyl]propoxy]phenyl]ethanone

Systemtic Name: 1-[2-oxidanyl-3-propyl-4-[3-[(1-sulfanylidene-1,3,4-thiadiazol-2-yl)sulfanyl]propoxy]phenyl]ethanone Openeye Name: 1-[2-hydroxy-3-propyl-4-[3-[(1-thioxo-1,3,4-thiadiazol-2-yl)sulfanyl]propoxy]phenyl]ethanone CAS Name: 1-[2-hydroxy-3-propyl-4-[3-[(1-sulfanylidene-1,3,4-thiadiazol-2-yl)thio]propoxy]phenyl]ethanone IUPAC Name: 1-[2-hydroxy-3-propyl-4-[3-[(1-sulfanylidene-1,3,4-thiadiazol-2-yl)sulfanyl]propoxy]phenyl]ethanone Traditional Name: 1-[2-hydroxy-3-propyl-4-[3-[(1-thioxo-1,3,4-thiadiazol-2-yl)thio]propoxy]phenyl]ethanone Formula: C16H20N2O3S3 MolecularWeight: 384.5366

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)C(=O)C)OCCCSC2=NN=CS2=S

Isomeric SMILES

CCCC1=C(C=CC(=C1O)C(=O)C)OCCCSC2=NN=CS2=S

InChI

InChI=1S/C16H20N2O3S3/c1-3-5-13-14(7-6-12(11(2)19)15(13)20)21-8-4-9-23-16-18-17-10-24(16)22/h6-7,10,20H,3-5,8-9H2,1-2H3