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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N(C2=CC=CC(=C2)CN)NC(=O)NC3=CC=C(C=C3)N4C(=O)C=CC=N4

Isomeric SMILES

C1=CC=C(C=C1)N(C2=CC=CC(=C2)CN)NC(=O)NC3=CC=C(C=C3)N4C(=O)C=CC=N4

InChI

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