2-[(3-bromophenyl)methylcarbamoylamino]-2-methyl-N-(6-pyrrolidin-1-ylpyridin-3-yl)propanamide

Systemtic Name: 2-[(3-bromophenyl)methylcarbamoylamino]-2-methyl-N-(6-pyrrolidin-1-ylpyridin-3-yl)propanamide Openeye Name: 2-[(3-bromophenyl)methylcarbamoylamino]-2-methyl-N-(6-pyrrolidin-1-yl-3-pyridyl)propanamide CAS Name: 2-[[[(3-bromophenyl)methylamino]-oxomethyl]amino]-2-methyl-N-[6-(1-pyrrolidinyl)-3-pyridinyl]propanamide IUPAC Name: 2-[(3-bromophenyl)methylcarbamoylamino]-2-methyl-N-(6-pyrrolidin-1-ylpyridin-3-yl)propanamide Traditional Name: 2-[(3-bromobenzyl)carbamoylamino]-2-methyl-N-(6-pyrrolidino-3-pyridyl)propionamide Formula: C21H26BrN5O2 MolecularWeight: 460.36744

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)NC1=CN=C(C=C1)N2CCCC2)NC(=O)NCC3=CC(=CC=C3)Br

Isomeric SMILES

CC(C)(C(=O)NC1=CN=C(C=C1)N2CCCC2)NC(=O)NCC3=CC(=CC=C3)Br

InChI

InChI=1S/C21H26BrN5O2/c1-21(2,26-20(29)24-13-15-6-5-7-16(22)12-15)19(28)25-17-8-9-18(23-14-17)27-10-3-4-11-27/h5-9,12,14H,3-4,10-11,13H2,1-2H3,(H,25,28)(H2,24,26,29)