1-tert-butyl-3-[(4-oxidanylidene-3H-phthalazin-1-yl)methyl]urea

Systemtic Name: 1-tert-butyl-3-[(4-oxidanylidene-3H-phthalazin-1-yl)methyl]urea Openeye Name: 1-tert-butyl-3-[(4-oxo-3H-phthalazin-1-yl)methyl]urea CAS Name: 1-tert-butyl-3-[(4-oxo-3H-phthalazin-1-yl)methyl]urea IUPAC Name: 1-tert-butyl-3-[(4-oxo-3H-phthalazin-1-yl)methyl]urea Traditional Name: 1-tert-butyl-3-[(4-keto-3H-phthalazin-1-yl)methyl]urea Formula: C14H18N4O2 MolecularWeight: 274.31832

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)NCC1=NNC(=O)C2=CC=CC=C21

Isomeric SMILES

CC(C)(C)NC(=O)NCC1=NNC(=O)C2=CC=CC=C21

InChI

InChI=1S/C14H18N4O2/c1-14(2,3)16-13(20)15-8-11-9-6-4-5-7-10(9)12(19)18-17-11/h4-7H,8H2,1-3H3,(H,18,19)(H2,15,16,20)