N-[1-[4-[[(3S)-3-methyl-4-pyrimidin-2-yl-piperazin-1-yl]methyl]phenyl]cyclopropyl]ethanamide

Systemtic Name: N-[1-[4-[[(3S)-3-methyl-4-pyrimidin-2-yl-piperazin-1-yl]methyl]phenyl]cyclopropyl]ethanamide Openeye Name: N-[1-[4-[[(3S)-3-methyl-4-pyrimidin-2-yl-piperazin-1-yl]methyl]phenyl]cyclopropyl]acetamide CAS Name: N-[1-[4-[[(3S)-3-methyl-4-(2-pyrimidinyl)-1-piperazinyl]methyl]phenyl]cyclopropyl]acetamide IUPAC Name: N-[1-[4-[[(3S)-3-methyl-4-pyrimidin-2-ylpiperazin-1-yl]methyl]phenyl]cyclopropyl]acetamide Traditional Name: N-[1-[4-[[(3S)-3-methyl-4-(2-pyrimidyl)piperazino]methyl]phenyl]cyclopropyl]acetamide Formula: C21H27N5O MolecularWeight: 365.47198

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C2=NC=CC=N2)CC3=CC=C(C=C3)C4(CC4)NC(=O)C

Isomeric SMILES

C[C@H]1CN(CCN1C2=NC=CC=N2)CC3=CC=C(C=C3)C4(CC4)NC(=O)C

InChI

InChI=1S/C21H27N5O/c1-16-14-25(12-13-26(16)20-22-10-3-11-23-20)15-18-4-6-19(7-5-18)21(8-9-21)24-17(2)27/h3-7,10-11,16H,8-9,12-15H2,1-2H3,(H,24,27)/t16-/m0/s1