(Z)-3-[1-[1-[(2-azanylpyridin-4-yl)methyl]piperidin-4-yl]carbonylpiperidin-4-yl]-3-pyridin-2-yl-1-pyrrolidin-1-yl-prop-2-en-1-one

Systemtic Name: (Z)-3-[1-[1-[(2-azanylpyridin-4-yl)methyl]piperidin-4-yl]carbonylpiperidin-4-yl]-3-pyridin-2-yl-1-pyrrolidin-1-yl-prop-2-en-1-one Openeye Name: (Z)-3-[1-[1-[(2-amino-4-pyridyl)methyl]piperidine-4-carbonyl]-4-piperidyl]-3-(2-pyridyl)-1-pyrrolidin-1-yl-prop-2-en-1-one CAS Name: (Z)-3-[1-[[1-[(2-amino-4-pyridinyl)methyl]-4-piperidinyl]-oxomethyl]-4-piperidinyl]-3-(2-pyridinyl)-1-(1-pyrrolidinyl)-2-propen-1-one IUPAC Name: (Z)-3-[1-[1-[(2-aminopyridin-4-yl)methyl]piperidine-4-carbonyl]piperidin-4-yl]-3-pyridin-2-yl-1-pyrrolidin-1-ylprop-2-en-1-one Traditional Name: (Z)-3-[1-[1-[(2-amino-4-pyridyl)methyl]isonipecotoyl]-4-piperidyl]-3-(2-pyridyl)-1-pyrrolidino-prop-2-en-1-one Formula: C29H38N6O2 MolecularWeight: 502.65102

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C=C(C2CCN(CC2)C(=O)C3CCN(CC3)CC4=CC(=NC=C4)N)C5=CC=CC=N5

Isomeric SMILES

C1CCN(C1)C(=O)/C=C(/C2CCN(CC2)C(=O)C3CCN(CC3)CC4=CC(=NC=C4)N)\C5=CC=CC=N5

InChI

InChI=1S/C29H38N6O2/c30-27-19-22(6-12-32-27)21-33-15-7-24(8-16-33)29(37)35-17-9-23(10-18-35)25(26-5-1-2-11-31-26)20-28(36)34-13-3-4-14-34/h1-2,5-6,11-12,19-20,23-24H,3-4,7-10,13-18,21H2,(H2,30,32)/b25-20-