4-[(3-bromanyl-4-methoxy-phenyl)methylideneamino]-3-[4-(diethylamino)phenyl]-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-[(3-bromanyl-4-methoxy-phenyl)methylideneamino]-3-[4-(diethylamino)phenyl]-1H-1,2,4-triazole-5-thione Openeye Name: 4-[(3-bromo-4-methoxy-phenyl)methyleneamino]-3-[4-(diethylamino)phenyl]-1H-1,2,4-triazole-5-thione CAS Name: 4-[(3-bromo-4-methoxyphenyl)methylideneamino]-3-[4-(diethylamino)phenyl]-1H-1,2,4-triazole-5-thione IUPAC Name: 4-[(3-bromo-4-methoxyphenyl)methylideneamino]-3-[4-(diethylamino)phenyl]-1H-1,2,4-triazole-5-thione Traditional Name: 4-[(3-bromo-4-methoxy-benzylidene)amino]-3-[4-(diethylamino)phenyl]-1H-1,2,4-triazole-5-thione Formula: C20H22BrN5OS MolecularWeight: 460.39058

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC=C(C=C1)C2=NNC(=S)N2N=CC3=CC(=C(C=C3)OC)Br

Isomeric SMILES

CCN(CC)C1=CC=C(C=C1)C2=NNC(=S)N2N=CC3=CC(=C(C=C3)OC)Br

InChI

InChI=1S/C20H22BrN5OS/c1-4-25(5-2)16-9-7-15(8-10-16)19-23-24-20(28)26(19)22-13-14-6-11-18(27-3)17(21)12-14/h6-13H,4-5H2,1-3H3,(H,24,28)