1-(4-bromophenyl)-3-[(5,6-diphenyl-1,2,4-triazin-3-yl)amino]thiourea

Systemtic Name: 1-(4-bromophenyl)-3-[(5,6-diphenyl-1,2,4-triazin-3-yl)amino]thiourea Openeye Name: 1-(4-bromophenyl)-3-[(5,6-diphenyl-1,2,4-triazin-3-yl)amino]thiourea CAS Name: 1-(4-bromophenyl)-3-[(5,6-diphenyl-1,2,4-triazin-3-yl)amino]thiourea IUPAC Name: 1-(4-bromophenyl)-3-[(5,6-diphenyl-1,2,4-triazin-3-yl)amino]thiourea Traditional Name: 1-(4-bromophenyl)-3-[(5,6-diphenyl-1,2,4-triazin-3-yl)amino]thiourea Formula: C22H17BrN6S MolecularWeight: 477.37958

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(N=NC(=N2)NNC(=S)NC3=CC=C(C=C3)Br)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C2=C(N=NC(=N2)NNC(=S)NC3=CC=C(C=C3)Br)C4=CC=CC=C4

InChI

InChI=1S/C22H17BrN6S/c23-17-11-13-18(14-12-17)24-22(30)29-28-21-25-19(15-7-3-1-4-8-15)20(26-27-21)16-9-5-2-6-10-16/h1-14H,(H2,24,29,30)(H,25,27,28)