1-methyl-5-[(3R)-3-methylpiperazin-1-yl]-3-propyl-N-pyrimidin-4-yl-pyrazolo[4,3-d]pyrimidin-7-amine

Systemtic Name: 1-methyl-5-[(3R)-3-methylpiperazin-1-yl]-3-propyl-N-pyrimidin-4-yl-pyrazolo[4,3-d]pyrimidin-7-amine Openeye Name: 1-methyl-5-[(3R)-3-methylpiperazin-1-yl]-3-propyl-N-pyrimidin-4-yl-pyrazolo[4,3-d]pyrimidin-7-amine CAS Name: 1-methyl-5-[(3R)-3-methyl-1-piperazinyl]-3-propyl-N-(4-pyrimidinyl)-7-pyrazolo[4,3-d]pyrimidinamine IUPAC Name: 1-methyl-5-[(3R)-3-methylpiperazin-1-yl]-3-propyl-N-pyrimidin-4-ylpyrazolo[4,3-d]pyrimidin-7-amine Traditional Name: [1-methyl-5-[(3R)-3-methylpiperazino]-3-propyl-pyrazolo[4,3-d]pyrimidin-7-yl]-(4-pyrimidyl)amine Formula: C18H25N9 MolecularWeight: 367.4514

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C2=C1N=C(N=C2NC3=NC=NC=C3)N4CCNC(C4)C)C

Isomeric SMILES

CCCC1=NN(C2=C1N=C(N=C2NC3=NC=NC=C3)N4CCN[C@@H](C4)C)C

InChI

InChI=1S/C18H25N9/c1-4-5-13-15-16(26(3)25-13)17(22-14-6-7-19-11-21-14)24-18(23-15)27-9-8-20-12(2)10-27/h6-7,11-12,20H,4-5,8-10H2,1-3H3,(H,19,21,22,23,24)/t12-/m1/s1