N-[(3R)-1-(phenylmethyl)pyrrolidin-3-yl]-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethanamide

Systemtic Name: N-[(3R)-1-(phenylmethyl)pyrrolidin-3-yl]-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethanamide Openeye Name: N-[(3R)-1-benzylpyrrolidin-3-yl]-2-(4-pyrimidin-2-ylpiperazin-1-yl)acetamide CAS Name: N-[(3R)-1-(phenylmethyl)-3-pyrrolidinyl]-2-[4-(2-pyrimidinyl)-1-piperazinyl]acetamide IUPAC Name: N-[(3R)-1-benzylpyrrolidin-3-yl]-2-(4-pyrimidin-2-ylpiperazin-1-yl)acetamide Traditional Name: N-[(3R)-1-benzylpyrrolidin-3-yl]-2-[4-(2-pyrimidyl)piperazino]acetamide Formula: C21H28N6O MolecularWeight: 380.48662

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC1NC(=O)CN2CCN(CC2)C3=NC=CC=N3)CC4=CC=CC=C4

Isomeric SMILES

C1CN(C[C@@H]1NC(=O)CN2CCN(CC2)C3=NC=CC=N3)CC4=CC=CC=C4

InChI

InChI=1S/C21H28N6O/c28-20(17-25-11-13-27(14-12-25)21-22-8-4-9-23-21)24-19-7-10-26(16-19)15-18-5-2-1-3-6-18/h1-6,8-9,19H,7,10-17H2,(H,24,28)/t19-/m1/s1