N-methyl-N-[4-[[(3S)-3-methylpiperazin-1-yl]methyl]phenyl]-6-pyrrol-1-yl-pyridine-3-carboxamide

Systemtic Name: N-methyl-N-[4-[[(3S)-3-methylpiperazin-1-yl]methyl]phenyl]-6-pyrrol-1-yl-pyridine-3-carboxamide Openeye Name: N-methyl-N-[4-[[(3S)-3-methylpiperazin-1-yl]methyl]phenyl]-6-pyrrol-1-yl-pyridine-3-carboxamide CAS Name: N-methyl-N-[4-[[(3S)-3-methyl-1-piperazinyl]methyl]phenyl]-6-(1-pyrrolyl)-3-pyridinecarboxamide IUPAC Name: N-methyl-N-[4-[[(3S)-3-methylpiperazin-1-yl]methyl]phenyl]-6-pyrrol-1-ylpyridine-3-carboxamide Traditional Name: N-methyl-N-[4-[[(3S)-3-methylpiperazino]methyl]phenyl]-6-pyrrol-1-yl-nicotinamide Formula: C23H27N5O MolecularWeight: 389.49338

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1)CC2=CC=C(C=C2)N(C)C(=O)C3=CN=C(C=C3)N4C=CC=C4

Isomeric SMILES

C[C@H]1CN(CCN1)CC2=CC=C(C=C2)N(C)C(=O)C3=CN=C(C=C3)N4C=CC=C4

InChI

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