6-azanyl-N-[1-[(1-but-2-ynoylpiperidin-4-yl)methyl]piperidin-4-yl]-5-chloranyl-2-methoxy-pyridine-3-carboxamide

Systemtic Name: 6-azanyl-N-[1-[(1-but-2-ynoylpiperidin-4-yl)methyl]piperidin-4-yl]-5-chloranyl-2-methoxy-pyridine-3-carboxamide Openeye Name: 6-amino-N-[1-[(1-but-2-ynoyl-4-piperidyl)methyl]-4-piperidyl]-5-chloro-2-methoxy-pyridine-3-carboxamide CAS Name: 6-amino-5-chloro-2-methoxy-N-[1-[[1-(1-oxobut-2-ynyl)-4-piperidinyl]methyl]-4-piperidinyl]-3-pyridinecarboxamide IUPAC Name: 6-amino-N-[1-[(1-but-2-ynoylpiperidin-4-yl)methyl]piperidin-4-yl]-5-chloro-2-methoxypyridine-3-carboxamide Traditional Name: 6-amino-N-[1-[(1-but-2-ynoyl-4-piperidyl)methyl]-4-piperidyl]-5-chloro-2-methoxy-nicotinamide Formula: C22H30ClN5O3 MolecularWeight: 447.9583

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Descriptors Computed from Structure

Canonical SMILES:

CC#CC(=O)N1CCC(CC1)CN2CCC(CC2)NC(=O)C3=CC(=C(N=C3OC)N)Cl

Isomeric SMILES

CC#CC(=O)N1CCC(CC1)CN2CCC(CC2)NC(=O)C3=CC(=C(N=C3OC)N)Cl

InChI

InChI=1S/C22H30ClN5O3/c1-3-4-19(29)28-11-5-15(6-12-28)14-27-9-7-16(8-10-27)25-21(30)17-13-18(23)20(24)26-22(17)31-2/h13,15-16H,5-12,14H2,1-2H3,(H2,24,26)(H,25,30)