3-azanyl-5-[3-[(4-methylphthalazin-1-yl)amino]propyl]-1H-pyrazole-4-carbonitrile

Systemtic Name: 3-azanyl-5-[3-[(4-methylphthalazin-1-yl)amino]propyl]-1H-pyrazole-4-carbonitrile Openeye Name: 3-amino-5-[3-[(4-methylphthalazin-1-yl)amino]propyl]-1H-pyrazole-4-carbonitrile CAS Name: 3-amino-5-[3-[(4-methyl-1-phthalazinyl)amino]propyl]-1H-pyrazole-4-carbonitrile IUPAC Name: 3-amino-5-[3-[(4-methylphthalazin-1-yl)amino]propyl]-1H-pyrazole-4-carbonitrile Traditional Name: 3-amino-5-[3-[(4-methylphthalazin-1-yl)amino]propyl]-1H-pyrazole-4-carbonitrile Formula: C16H17N7 MolecularWeight: 307.35308

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(C2=CC=CC=C12)NCCCC3=C(C(=NN3)N)C#N

Isomeric SMILES

CC1=NN=C(C2=CC=CC=C12)NCCCC3=C(C(=NN3)N)C#N

InChI

InChI=1S/C16H17N7/c1-10-11-5-2-3-6-12(11)16(23-20-10)19-8-4-7-14-13(9-17)15(18)22-21-14/h2-3,5-6H,4,7-8H2,1H3,(H,19,23)(H3,18,21,22)