tert-butyl 4-[[3-[[(6-methylpyridin-3-yl)carbamoylamino]methyl]phenyl]methyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[[3-[[(6-methylpyridin-3-yl)carbamoylamino]methyl]phenyl]methyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[[3-[[(6-methyl-3-pyridyl)carbamoylamino]methyl]phenyl]methyl]piperazine-1-carboxylate CAS Name: 4-[[3-[[[[(6-methyl-3-pyridinyl)amino]-oxomethyl]amino]methyl]phenyl]methyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[[3-[[(6-methylpyridin-3-yl)carbamoylamino]methyl]phenyl]methyl]piperazine-1-carboxylate Traditional Name: 4-[3-[[(6-methyl-3-pyridyl)carbamoylamino]methyl]benzyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C24H33N5O3 MolecularWeight: 439.55052

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C=C1)NC(=O)NCC2=CC=CC(=C2)CN3CCN(CC3)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=NC=C(C=C1)NC(=O)NCC2=CC=CC(=C2)CN3CCN(CC3)C(=O)OC(C)(C)C

InChI

InChI=1S/C24H33N5O3/c1-18-8-9-21(16-25-18)27-22(30)26-15-19-6-5-7-20(14-19)17-28-10-12-29(13-11-28)23(31)32-24(2,3)4/h5-9,14,16H,10-13,15,17H2,1-4H3,(H2,26,27,30)