1-[2-(5-cyano-6-oxidanylidene-3,4-diphenyl-pyridazin-1-yl)ethanoylamino]-3-phenyl-thiourea

Systemtic Name: 1-[2-(5-cyano-6-oxidanylidene-3,4-diphenyl-pyridazin-1-yl)ethanoylamino]-3-phenyl-thiourea Openeye Name: 1-[[2-(5-cyano-6-oxo-3,4-diphenyl-pyridazin-1-yl)acetyl]amino]-3-phenyl-thiourea CAS Name: 1-[[2-(5-cyano-6-oxo-3,4-diphenyl-1-pyridazinyl)-1-oxoethyl]amino]-3-phenylthiourea IUPAC Name: 1-[[2-(5-cyano-6-oxo-3,4-diphenylpyridazin-1-yl)acetyl]amino]-3-phenylthiourea Traditional Name: 1-[[2-(5-cyano-6-keto-3,4-diphenyl-pyridazin-1-yl)acetyl]amino]-3-phenyl-thiourea Formula: C26H20N6O2S MolecularWeight: 480.541

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C(=O)N(N=C2C3=CC=CC=C3)CC(=O)NNC(=S)NC4=CC=CC=C4)C#N

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C(=O)N(N=C2C3=CC=CC=C3)CC(=O)NNC(=S)NC4=CC=CC=C4)C#N

InChI

InChI=1S/C26H20N6O2S/c27-16-21-23(18-10-4-1-5-11-18)24(19-12-6-2-7-13-19)31-32(25(21)34)17-22(33)29-30-26(35)28-20-14-8-3-9-15-20/h1-15H,17H2,(H,29,33)(H2,28,30,35)