4-[[3-ethoxy-4-(thiophen-2-ylmethoxy)phenyl]methylamino]-3-ethyl-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-[[3-ethoxy-4-(thiophen-2-ylmethoxy)phenyl]methylamino]-3-ethyl-1H-1,2,4-triazole-5-thione Openeye Name: 4-[[3-ethoxy-4-(2-thienylmethoxy)phenyl]methylamino]-3-ethyl-1H-1,2,4-triazole-5-thione CAS Name: 4-[[3-ethoxy-4-(thiophen-2-ylmethoxy)phenyl]methylamino]-3-ethyl-1H-1,2,4-triazole-5-thione IUPAC Name: 4-[[3-ethoxy-4-(thiophen-2-ylmethoxy)phenyl]methylamino]-3-ethyl-1H-1,2,4-triazole-5-thione Traditional Name: 4-[[3-ethoxy-4-(2-thenyloxy)benzyl]amino]-3-ethyl-1H-1,2,4-triazole-5-thione Formula: C18H22N4O2S2 MolecularWeight: 390.52288

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=NNC(=S)N1NCC2=CC(=C(C=C2)OCC3=CC=CS3)OCC

Isomeric SMILES

CCC1=NNC(=S)N1NCC2=CC(=C(C=C2)OCC3=CC=CS3)OCC

InChI

InChI=1S/C18H22N4O2S2/c1-3-17-20-21-18(25)22(17)19-11-13-7-8-15(16(10-13)23-4-2)24-12-14-6-5-9-26-14/h5-10,19H,3-4,11-12H2,1-2H3,(H,21,25)