4-azanyl-2-[4-(diphenylmethyl)piperazin-1-yl]pyrimidine-5-carbonitrile

Systemtic Name: 4-azanyl-2-[4-(diphenylmethyl)piperazin-1-yl]pyrimidine-5-carbonitrile Openeye Name: 4-amino-2-(4-benzhydrylpiperazin-1-yl)pyrimidine-5-carbonitrile CAS Name: 4-amino-2-[4-(diphenylmethyl)-1-piperazinyl]-5-pyrimidinecarbonitrile IUPAC Name: 4-amino-2-(4-benzhydrylpiperazin-1-yl)pyrimidine-5-carbonitrile Traditional Name: 4-amino-2-(4-benzhydrylpiperazino)pyrimidine-5-carbonitrile Formula: C22H22N6 MolecularWeight: 370.45028

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=C(C(=N2)N)C#N)C(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C2=NC=C(C(=N2)N)C#N)C(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C22H22N6/c23-15-19-16-25-22(26-21(19)24)28-13-11-27(12-14-28)20(17-7-3-1-4-8-17)18-9-5-2-6-10-18/h1-10,16,20H,11-14H2,(H2,24,25,26)