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

Systemtic Name: N-methyl-N-[4-[[(3S)-3-methylpiperazin-1-yl]methyl]phenyl]-4-pyrazol-1-yl-benzamide Openeye Name: N-methyl-N-[4-[[(3S)-3-methylpiperazin-1-yl]methyl]phenyl]-4-pyrazol-1-yl-benzamide CAS Name: N-methyl-N-[4-[[(3S)-3-methyl-1-piperazinyl]methyl]phenyl]-4-(1-pyrazolyl)benzamide IUPAC Name: N-methyl-N-[4-[[(3S)-3-methylpiperazin-1-yl]methyl]phenyl]-4-pyrazol-1-ylbenzamide Traditional Name: N-methyl-N-[4-[[(3S)-3-methylpiperazino]methyl]phenyl]-4-pyrazol-1-yl-benzamide Formula: C23H27N5O MolecularWeight: 389.49338

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1)CC2=CC=C(C=C2)N(C)C(=O)C3=CC=C(C=C3)N4C=CC=N4

Isomeric SMILES

C[C@H]1CN(CCN1)CC2=CC=C(C=C2)N(C)C(=O)C3=CC=C(C=C3)N4C=CC=N4

InChI

InChI=1S/C23H27N5O/c1-18-16-27(15-13-24-18)17-19-4-8-21(9-5-19)26(2)23(29)20-6-10-22(11-7-20)28-14-3-12-25-28/h3-12,14,18,24H,13,15-17H2,1-2H3/t18-/m0/s1