1,3-dimethyl-5-[4-(phenylmethyl)piperazin-4-ium-1-yl]-6-propyl-pyrazolo[4,3-d]pyrimidin-7-one

Systemtic Name: 1,3-dimethyl-5-[4-(phenylmethyl)piperazin-4-ium-1-yl]-6-propyl-pyrazolo[4,3-d]pyrimidin-7-one Openeye Name: 5-(4-benzylpiperazin-4-ium-1-yl)-1,3-dimethyl-6-propyl-pyrazolo[4,3-d]pyrimidin-7-one CAS Name: 1,3-dimethyl-5-[4-(phenylmethyl)-1-piperazin-4-iumyl]-6-propyl-7-pyrazolo[4,3-d]pyrimidinone IUPAC Name: 5-(4-benzylpiperazin-4-ium-1-yl)-1,3-dimethyl-6-propylpyrazolo[4,3-d]pyrimidin-7-one Traditional Name: 5-(4-benzylpiperazin-4-ium-1-yl)-1,3-dimethyl-6-propyl-pyrazolo[4,3-d]pyrimidin-7-one Formula: C21H29N6O+ MolecularWeight: 381.49456

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=C(C(=NN2C)C)N=C1N3CC[NH+](CC3)CC4=CC=CC=C4

Isomeric SMILES

CCCN1C(=O)C2=C(C(=NN2C)C)N=C1N3CC[NH+](CC3)CC4=CC=CC=C4

InChI

InChI=1S/C21H28N6O/c1-4-10-27-20(28)19-18(16(2)23-24(19)3)22-21(27)26-13-11-25(12-14-26)15-17-8-6-5-7-9-17/h5-9H,4,10-15H2,1-3H3/p+1