6-[4-[(3S)-3-methyl-4-propan-2-yl-piperazin-1-yl]carbonylpiperidin-1-yl]pyridine-3-carbonitrile

Systemtic Name: 6-[4-[(3S)-3-methyl-4-propan-2-yl-piperazin-1-yl]carbonylpiperidin-1-yl]pyridine-3-carbonitrile Openeye Name: 6-[4-[(3S)-4-isopropyl-3-methyl-piperazine-1-carbonyl]-1-piperidyl]pyridine-3-carbonitrile CAS Name: 6-[4-[[(3S)-3-methyl-4-propan-2-yl-1-piperazinyl]-oxomethyl]-1-piperidinyl]-3-pyridinecarbonitrile IUPAC Name: 6-[4-[(3S)-3-methyl-4-propan-2-ylpiperazine-1-carbonyl]piperidin-1-yl]pyridine-3-carbonitrile Traditional Name: 6-[4-[(3S)-4-isopropyl-3-methyl-piperazine-1-carbonyl]piperidino]nicotinonitrile Formula: C20H29N5O MolecularWeight: 355.47716

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C(C)C)C(=O)C2CCN(CC2)C3=NC=C(C=C3)C#N

Isomeric SMILES

C[C@H]1CN(CCN1C(C)C)C(=O)C2CCN(CC2)C3=NC=C(C=C3)C#N

InChI

InChI=1S/C20H29N5O/c1-15(2)25-11-10-24(14-16(25)3)20(26)18-6-8-23(9-7-18)19-5-4-17(12-21)13-22-19/h4-5,13,15-16,18H,6-11,14H2,1-3H3/t16-/m0/s1