1-[2-[(2,2-dicyano-1-pyridin-3-yl-ethenyl)amino]phenyl]-3-(6-phenylpyridazin-3-yl)thiourea

Systemtic Name: 1-[2-[(2,2-dicyano-1-pyridin-3-yl-ethenyl)amino]phenyl]-3-(6-phenylpyridazin-3-yl)thiourea Openeye Name: 1-[2-[[2,2-dicyano-1-(3-pyridyl)vinyl]amino]phenyl]-3-(6-phenylpyridazin-3-yl)thiourea CAS Name: 1-[2-[[2,2-dicyano-1-(3-pyridinyl)ethenyl]amino]phenyl]-3-(6-phenyl-3-pyridazinyl)thiourea IUPAC Name: 1-[2-[(2,2-dicyano-1-pyridin-3-ylethenyl)amino]phenyl]-3-(6-phenylpyridazin-3-yl)thiourea Traditional Name: 1-[2-[[2,2-dicyano-1-(3-pyridyl)vinyl]amino]phenyl]-3-(6-phenylpyridazin-3-yl)thiourea Formula: C26H18N8S MolecularWeight: 474.53972

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN=C(C=C2)NC(=S)NC3=CC=CC=C3NC(=C(C#N)C#N)C4=CN=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C2=NN=C(C=C2)NC(=S)NC3=CC=CC=C3NC(=C(C#N)C#N)C4=CN=CC=C4

InChI

InChI=1S/C26H18N8S/c27-15-20(16-28)25(19-9-6-14-29-17-19)30-22-10-4-5-11-23(22)31-26(35)32-24-13-12-21(33-34-24)18-7-2-1-3-8-18/h1-14,17,30H,(H2,31,32,34,35)