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

Systemtic Name: 5-(4-bromophenyl)-2-(morpholin-4-ylmethyl)-4-phenyl-1,2,4-triazole-3-thione Openeye Name: 5-(4-bromophenyl)-2-(morpholinomethyl)-4-phenyl-1,2,4-triazole-3-thione CAS Name: 5-(4-bromophenyl)-2-(4-morpholinylmethyl)-4-phenyl-1,2,4-triazole-3-thione IUPAC Name: 5-(4-bromophenyl)-2-(morpholin-4-ylmethyl)-4-phenyl-1,2,4-triazole-3-thione Traditional Name: 5-(4-bromophenyl)-2-(morpholinomethyl)-4-phenyl-1,2,4-triazole-3-thione Formula: C19H19BrN4OS MolecularWeight: 431.34936

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CN2C(=S)N(C(=N2)C3=CC=C(C=C3)Br)C4=CC=CC=C4

Isomeric SMILES

C1COCCN1CN2C(=S)N(C(=N2)C3=CC=C(C=C3)Br)C4=CC=CC=C4

InChI

InChI=1S/C19H19BrN4OS/c20-16-8-6-15(7-9-16)18-21-23(14-22-10-12-25-13-11-22)19(26)24(18)17-4-2-1-3-5-17/h1-9H,10-14H2