2-[2-(cyclooctylamino)-2-oxidanylidene-ethyl]sulfanyl-N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)benzamide

Systemtic Name: 2-[2-(cyclooctylamino)-2-oxidanylidene-ethyl]sulfanyl-N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)benzamide Openeye Name: 2-[2-(cyclooctylamino)-2-oxo-ethyl]sulfanyl-N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)benzamide CAS Name: 2-[[2-(cyclooctylamino)-2-oxoethyl]thio]-N-[5-(ethylthio)-1,3,4-thiadiazol-2-yl]benzamide IUPAC Name: 2-[2-(cyclooctylamino)-2-oxoethyl]sulfanyl-N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)benzamide Traditional Name: 2-[[2-(cyclooctylamino)-2-keto-ethyl]thio]-N-[5-(ethylthio)-1,3,4-thiadiazol-2-yl]benzamide Formula: C21H28N4O2S3 MolecularWeight: 464.66762

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NN=C(S1)NC(=O)C2=CC=CC=C2SCC(=O)NC3CCCCCCC3

Isomeric SMILES

CCSC1=NN=C(S1)NC(=O)C2=CC=CC=C2SCC(=O)NC3CCCCCCC3

InChI

InChI=1S/C21H28N4O2S3/c1-2-28-21-25-24-20(30-21)23-19(27)16-12-8-9-13-17(16)29-14-18(26)22-15-10-6-4-3-5-7-11-15/h8-9,12-13,15H,2-7,10-11,14H2,1H3,(H,22,26)(H,23,24,27)