N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-[[5-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)-4-phenethyl-1H-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-[[5-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)-4-phenethyl-1H-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-[[5-(6-oxocyclohexa-2,4-dien-1-ylidene)-4-phenethyl-1H-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-[[5-(6-oxo-1-cyclohexa-2,4-dienylidene)-4-phenethyl-1H-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-[[5-(6-oxocyclohexa-2,4-dien-1-ylidene)-4-phenethyl-1H-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-[[5-(6-ketocyclohexa-2,4-dien-1-ylidene)-4-phenethyl-1H-1,2,4-triazol-3-yl]thio]acetamide Formula: C22H22N6O2S2 MolecularWeight: 466.57908

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN=C(S1)NC(=O)CSC2=NNC(=C3C=CC=CC3=O)N2CCC4=CC=CC=C4

Isomeric SMILES

CCC1=NN=C(S1)NC(=O)CSC2=NNC(=C3C=CC=CC3=O)N2CCC4=CC=CC=C4

InChI

InChI=1S/C22H22N6O2S2/c1-2-19-24-26-21(32-19)23-18(30)14-31-22-27-25-20(16-10-6-7-11-17(16)29)28(22)13-12-15-8-4-3-5-9-15/h3-11,25H,2,12-14H2,1H3,(H,23,26,30)