1-methyl-3-[1-methyl-4-oxidanylidene-3-propan-2-yl-5-(1H-pyrazol-5-ylamino)phthalazin-6-yl]urea

Systemtic Name: 1-methyl-3-[1-methyl-4-oxidanylidene-3-propan-2-yl-5-(1H-pyrazol-5-ylamino)phthalazin-6-yl]urea Openeye Name: 1-[3-isopropyl-1-methyl-4-oxo-5-(1H-pyrazol-5-ylamino)phthalazin-6-yl]-3-methyl-urea CAS Name: 1-methyl-3-[1-methyl-4-oxo-3-propan-2-yl-5-(1H-pyrazol-5-ylamino)-6-phthalazinyl]urea IUPAC Name: 1-methyl-3-[1-methyl-4-oxo-3-propan-2-yl-5-(1H-pyrazol-5-ylamino)phthalazin-6-yl]urea Traditional Name: 1-[3-isopropyl-4-keto-1-methyl-5-(1H-pyrazol-5-ylamino)phthalazin-6-yl]-3-methyl-urea Formula: C17H21N7O2 MolecularWeight: 355.39434

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C2=C1C=CC(=C2NC3=CC=NN3)NC(=O)NC)C(C)C

Isomeric SMILES

CC1=NN(C(=O)C2=C1C=CC(=C2NC3=CC=NN3)NC(=O)NC)C(C)C

InChI

InChI=1S/C17H21N7O2/c1-9(2)24-16(25)14-11(10(3)23-24)5-6-12(20-17(26)18-4)15(14)21-13-7-8-19-22-13/h5-9H,1-4H3,(H2,18,20,26)(H2,19,21,22)