1-[[3-(aminomethyl)phenyl]amino]-3-[4-(6-oxidanylidenepyridazin-1-yl)phenyl]-1-phenyl-urea

Systemtic Name: 1-[[3-(aminomethyl)phenyl]amino]-3-[4-(6-oxidanylidenepyridazin-1-yl)phenyl]-1-phenyl-urea Openeye Name: 1-[3-(aminomethyl)anilino]-3-[4-(6-oxopyridazin-1-yl)phenyl]-1-phenyl-urea CAS Name: 1-[3-(aminomethyl)anilino]-3-[4-(6-oxo-1-pyridazinyl)phenyl]-1-phenylurea IUPAC Name: 1-[3-(aminomethyl)anilino]-3-[4-(6-oxopyridazin-1-yl)phenyl]-1-phenylurea Traditional Name: 1-[3-(aminomethyl)anilino]-3-[4-(6-ketopyridazin-1-yl)phenyl]-1-phenyl-urea Formula: C24H22N6O2 MolecularWeight: 426.47048

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N(C(=O)NC2=CC=C(C=C2)N3C(=O)C=CC=N3)NC4=CC=CC(=C4)CN

Isomeric SMILES

C1=CC=C(C=C1)N(C(=O)NC2=CC=C(C=C2)N3C(=O)C=CC=N3)NC4=CC=CC(=C4)CN

InChI

InChI=1S/C24H22N6O2/c25-17-18-6-4-7-20(16-18)28-30(21-8-2-1-3-9-21)24(32)27-19-11-13-22(14-12-19)29-23(31)10-5-15-26-29/h1-16,28H,17,25H2,(H,27,32)