5-(3-ethoxypropylamino)-3-[[4-(4-methoxyphenyl)piperazin-1-yl]methyl]-1,3,4-thiadiazole-2-thione

Systemtic Name: 5-(3-ethoxypropylamino)-3-[[4-(4-methoxyphenyl)piperazin-1-yl]methyl]-1,3,4-thiadiazole-2-thione Openeye Name: 5-(3-ethoxypropylamino)-3-[[4-(4-methoxyphenyl)piperazin-1-yl]methyl]-1,3,4-thiadiazole-2-thione CAS Name: 5-(3-ethoxypropylamino)-3-[[4-(4-methoxyphenyl)-1-piperazinyl]methyl]-1,3,4-thiadiazole-2-thione IUPAC Name: 5-(3-ethoxypropylamino)-3-[[4-(4-methoxyphenyl)piperazin-1-yl]methyl]-1,3,4-thiadiazole-2-thione Traditional Name: 5-(3-ethoxypropylamino)-3-[[4-(4-methoxyphenyl)piperazino]methyl]-1,3,4-thiadiazole-2-thione Formula: C19H29N5O2S2 MolecularWeight: 423.59586

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOCCCNC1=NN(C(=S)S1)CN2CCN(CC2)C3=CC=C(C=C3)OC

Isomeric SMILES

CCOCCCNC1=NN(C(=S)S1)CN2CCN(CC2)C3=CC=C(C=C3)OC

InChI

InChI=1S/C19H29N5O2S2/c1-3-26-14-4-9-20-18-21-24(19(27)28-18)15-22-10-12-23(13-11-22)16-5-7-17(25-2)8-6-16/h5-8H,3-4,9-15H2,1-2H3,(H,20,21)