tert-butyl 4-[methyl-[(5-pyridin-4-ylpyrazin-2-yl)methyl]amino]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[methyl-[(5-pyridin-4-ylpyrazin-2-yl)methyl]amino]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[methyl-[[5-(4-pyridyl)pyrazin-2-yl]methyl]amino]piperidine-1-carboxylate CAS Name: 4-[methyl-[(5-pyridin-4-yl-2-pyrazinyl)methyl]amino]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[methyl-[(5-pyridin-4-ylpyrazin-2-yl)methyl]amino]piperidine-1-carboxylate Traditional Name: 4-[methyl-[[5-(4-pyridyl)pyrazin-2-yl]methyl]amino]piperidine-1-carboxylic acid tert-butyl ester Formula: C21H29N5O2 MolecularWeight: 383.48726

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)N(C)CC2=NC=C(N=C2)C3=CC=NC=C3

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)N(C)CC2=NC=C(N=C2)C3=CC=NC=C3

InChI

InChI=1S/C21H29N5O2/c1-21(2,3)28-20(27)26-11-7-18(8-12-26)25(4)15-17-13-24-19(14-23-17)16-5-9-22-10-6-16/h5-6,9-10,13-14,18H,7-8,11-12,15H2,1-4H3