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

Systemtic Name: 3-phenyl-4-[[4-(thiophen-2-ylmethoxy)phenyl]methylamino]-1H-1,2,4-triazole-5-thione Openeye Name: 3-phenyl-4-[[4-(2-thienylmethoxy)phenyl]methylamino]-1H-1,2,4-triazole-5-thione CAS Name: 3-phenyl-4-[[4-(thiophen-2-ylmethoxy)phenyl]methylamino]-1H-1,2,4-triazole-5-thione IUPAC Name: 3-phenyl-4-[[4-(thiophen-2-ylmethoxy)phenyl]methylamino]-1H-1,2,4-triazole-5-thione Traditional Name: 3-phenyl-4-[[4-(2-thenyloxy)benzyl]amino]-1H-1,2,4-triazole-5-thione Formula: C20H18N4OS2 MolecularWeight: 394.51312

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NNC(=S)N2NCC3=CC=C(C=C3)OCC4=CC=CS4

Isomeric SMILES

C1=CC=C(C=C1)C2=NNC(=S)N2NCC3=CC=C(C=C3)OCC4=CC=CS4

InChI

InChI=1S/C20H18N4OS2/c26-20-23-22-19(16-5-2-1-3-6-16)24(20)21-13-15-8-10-17(11-9-15)25-14-18-7-4-12-27-18/h1-12,21H,13-14H2,(H,23,26)