1-[1-(3,3-dimethylbutyl)-4-oxidanylidene-3H-phthalazin-6-yl]-3-(3-methoxyphenyl)urea

Systemtic Name: 1-[1-(3,3-dimethylbutyl)-4-oxidanylidene-3H-phthalazin-6-yl]-3-(3-methoxyphenyl)urea Openeye Name: 1-[1-(3,3-dimethylbutyl)-4-oxo-3H-phthalazin-6-yl]-3-(3-methoxyphenyl)urea CAS Name: 1-[1-(3,3-dimethylbutyl)-4-oxo-3H-phthalazin-6-yl]-3-(3-methoxyphenyl)urea IUPAC Name: 1-[1-(3,3-dimethylbutyl)-4-oxo-3H-phthalazin-6-yl]-3-(3-methoxyphenyl)urea Traditional Name: 1-[1-(3,3-dimethylbutyl)-4-keto-3H-phthalazin-6-yl]-3-(3-methoxyphenyl)urea Formula: C22H26N4O3 MolecularWeight: 394.46684

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CCC1=NNC(=O)C2=C1C=CC(=C2)NC(=O)NC3=CC(=CC=C3)OC

Isomeric SMILES

CC(C)(C)CCC1=NNC(=O)C2=C1C=CC(=C2)NC(=O)NC3=CC(=CC=C3)OC

InChI

InChI=1S/C22H26N4O3/c1-22(2,3)11-10-19-17-9-8-15(13-18(17)20(27)26-25-19)24-21(28)23-14-6-5-7-16(12-14)29-4/h5-9,12-13H,10-11H2,1-4H3,(H,26,27)(H2,23,24,28)