N-methyl-N-[4-[[(3S)-3-methylpiperazin-1-yl]methyl]phenyl]-4-pyrimidin-2-yl-benzamide

Systemtic Name: N-methyl-N-[4-[[(3S)-3-methylpiperazin-1-yl]methyl]phenyl]-4-pyrimidin-2-yl-benzamide Openeye Name: N-methyl-N-[4-[[(3S)-3-methylpiperazin-1-yl]methyl]phenyl]-4-pyrimidin-2-yl-benzamide CAS Name: N-methyl-N-[4-[[(3S)-3-methyl-1-piperazinyl]methyl]phenyl]-4-(2-pyrimidinyl)benzamide IUPAC Name: N-methyl-N-[4-[[(3S)-3-methylpiperazin-1-yl]methyl]phenyl]-4-pyrimidin-2-ylbenzamide Traditional Name: N-methyl-N-[4-[[(3S)-3-methylpiperazino]methyl]phenyl]-4-(2-pyrimidyl)benzamide Formula: C24H27N5O MolecularWeight: 401.50408

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1)CC2=CC=C(C=C2)N(C)C(=O)C3=CC=C(C=C3)C4=NC=CC=N4

Isomeric SMILES

C[C@H]1CN(CCN1)CC2=CC=C(C=C2)N(C)C(=O)C3=CC=C(C=C3)C4=NC=CC=N4

InChI

InChI=1S/C24H27N5O/c1-18-16-29(15-14-25-18)17-19-4-10-22(11-5-19)28(2)24(30)21-8-6-20(7-9-21)23-26-12-3-13-27-23/h3-13,18,25H,14-17H2,1-2H3/t18-/m0/s1