(2S)-2-[methyl(2-pyridin-4-ylethyl)amino]-1-piperazin-1-yl-2-(1H-pyrrol-2-yl)ethanone

Systemtic Name: (2S)-2-[methyl(2-pyridin-4-ylethyl)amino]-1-piperazin-1-yl-2-(1H-pyrrol-2-yl)ethanone Openeye Name: (2S)-2-[methyl-[2-(4-pyridyl)ethyl]amino]-1-piperazin-1-yl-2-(1H-pyrrol-2-yl)ethanone CAS Name: (2S)-2-[methyl(2-pyridin-4-ylethyl)amino]-1-(1-piperazinyl)-2-(1H-pyrrol-2-yl)ethanone IUPAC Name: (2S)-2-[methyl(2-pyridin-4-ylethyl)amino]-1-piperazin-1-yl-2-(1H-pyrrol-2-yl)ethanone Traditional Name: (2S)-2-[methyl-[2-(4-pyridyl)ethyl]amino]-1-piperazino-2-(1H-pyrrol-2-yl)ethanone Formula: C18H25N5O MolecularWeight: 327.424

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC=NC=C1)C(C2=CC=CN2)C(=O)N3CCNCC3

Isomeric SMILES

CN(CCC1=CC=NC=C1)[C@@H](C2=CC=CN2)C(=O)N3CCNCC3

InChI

InChI=1S/C18H25N5O/c1-22(12-6-15-4-8-19-9-5-15)17(16-3-2-7-21-16)18(24)23-13-10-20-11-14-23/h2-5,7-9,17,20-21H,6,10-14H2,1H3/t17-/m0/s1