N-(4-bromanyl-2-methyl-phenyl)-2-[(6-pyrazol-1-ylpyridin-3-yl)methylcarbamoylamino]ethanamide

Systemtic Name: N-(4-bromanyl-2-methyl-phenyl)-2-[(6-pyrazol-1-ylpyridin-3-yl)methylcarbamoylamino]ethanamide Openeye Name: N-(4-bromo-2-methyl-phenyl)-2-[(6-pyrazol-1-yl-3-pyridyl)methylcarbamoylamino]acetamide CAS Name: N-(4-bromo-2-methylphenyl)-2-[[oxo-[[6-(1-pyrazolyl)-3-pyridinyl]methylamino]methyl]amino]acetamide IUPAC Name: N-(4-bromo-2-methylphenyl)-2-[(6-pyrazol-1-ylpyridin-3-yl)methylcarbamoylamino]acetamide Traditional Name: N-(4-bromo-2-methyl-phenyl)-2-[(6-pyrazol-1-yl-3-pyridyl)methylcarbamoylamino]acetamide Formula: C19H19BrN6O2 MolecularWeight: 443.29716

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)CNC(=O)NCC2=CN=C(C=C2)N3C=CC=N3

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)CNC(=O)NCC2=CN=C(C=C2)N3C=CC=N3

InChI

InChI=1S/C19H19BrN6O2/c1-13-9-15(20)4-5-16(13)25-18(27)12-23-19(28)22-11-14-3-6-17(21-10-14)26-8-2-7-24-26/h2-10H,11-12H2,1H3,(H,25,27)(H2,22,23,28)