5-methyl-3-[[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]methyl]-1,3,4-thiadiazole-2-thione

Systemtic Name: 5-methyl-3-[[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]methyl]-1,3,4-thiadiazole-2-thione Openeye Name: 3-[[4-[(E)-cinnamyl]piperazin-1-yl]methyl]-5-methyl-1,3,4-thiadiazole-2-thione CAS Name: 5-methyl-3-[[4-[(E)-3-phenylprop-2-enyl]-1-piperazinyl]methyl]-1,3,4-thiadiazole-2-thione IUPAC Name: 5-methyl-3-[[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]methyl]-1,3,4-thiadiazole-2-thione Traditional Name: 3-[[4-[(E)-cinnamyl]piperazino]methyl]-5-methyl-1,3,4-thiadiazole-2-thione Formula: C17H22N4S2 MolecularWeight: 346.51338

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=S)S1)CN2CCN(CC2)CC=CC3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(=S)S1)CN2CCN(CC2)C/C=C/C3=CC=CC=C3

InChI

InChI=1S/C17H22N4S2/c1-15-18-21(17(22)23-15)14-20-12-10-19(11-13-20)9-5-8-16-6-3-2-4-7-16/h2-8H,9-14H2,1H3/b8-5+