2-(morpholin-4-ylmethyl)-4-phenyl-5-(4-phenylmethoxyphenyl)-1,2,4-triazole-3-thione

Systemtic Name: 2-(morpholin-4-ylmethyl)-4-phenyl-5-(4-phenylmethoxyphenyl)-1,2,4-triazole-3-thione Openeye Name: 5-(4-benzyloxyphenyl)-2-(morpholinomethyl)-4-phenyl-1,2,4-triazole-3-thione CAS Name: 2-(4-morpholinylmethyl)-4-phenyl-5-(4-phenylmethoxyphenyl)-1,2,4-triazole-3-thione IUPAC Name: 2-(morpholin-4-ylmethyl)-4-phenyl-5-(4-phenylmethoxyphenyl)-1,2,4-triazole-3-thione Traditional Name: 5-(4-benzoxyphenyl)-2-(morpholinomethyl)-4-phenyl-1,2,4-triazole-3-thione Formula: C26H26N4O2S MolecularWeight: 458.57524

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CN2C(=S)N(C(=N2)C3=CC=C(C=C3)OCC4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1COCCN1CN2C(=S)N(C(=N2)C3=CC=C(C=C3)OCC4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C26H26N4O2S/c33-26-29(20-28-15-17-31-18-16-28)27-25(30(26)23-9-5-2-6-10-23)22-11-13-24(14-12-22)32-19-21-7-3-1-4-8-21/h1-14H,15-20H2