2-[4-[4-(phenylmethyl)phthalazin-1-yl]piperazin-1-yl]pyrimidine-5-carbonitrile

Systemtic Name: 2-[4-[4-(phenylmethyl)phthalazin-1-yl]piperazin-1-yl]pyrimidine-5-carbonitrile Openeye Name: 2-[4-(4-benzylphthalazin-1-yl)piperazin-1-yl]pyrimidine-5-carbonitrile CAS Name: 2-[4-[4-(phenylmethyl)-1-phthalazinyl]-1-piperazinyl]-5-pyrimidinecarbonitrile IUPAC Name: 2-[4-(4-benzylphthalazin-1-yl)piperazin-1-yl]pyrimidine-5-carbonitrile Traditional Name: 2-[4-(4-benzylphthalazin-1-yl)piperazino]pyrimidine-5-carbonitrile Formula: C24H21N7 MolecularWeight: 407.47044

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NN=C(C3=CC=CC=C32)CC4=CC=CC=C4)C5=NC=C(C=N5)C#N

Isomeric SMILES

C1CN(CCN1C2=NN=C(C3=CC=CC=C32)CC4=CC=CC=C4)C5=NC=C(C=N5)C#N

InChI

InChI=1S/C24H21N7/c25-15-19-16-26-24(27-17-19)31-12-10-30(11-13-31)23-21-9-5-4-8-20(21)22(28-29-23)14-18-6-2-1-3-7-18/h1-9,16-17H,10-14H2