4-[(propan-2-ylcarbamoylamino)methyl]-N-[(6-pyrrolidin-1-ylpyridin-3-yl)methyl]benzamide

Systemtic Name: 4-[(propan-2-ylcarbamoylamino)methyl]-N-[(6-pyrrolidin-1-ylpyridin-3-yl)methyl]benzamide Openeye Name: 4-[(isopropylcarbamoylamino)methyl]-N-[(6-pyrrolidin-1-yl-3-pyridyl)methyl]benzamide CAS Name: 4-[[[oxo-(propan-2-ylamino)methyl]amino]methyl]-N-[[6-(1-pyrrolidinyl)-3-pyridinyl]methyl]benzamide IUPAC Name: 4-[(propan-2-ylcarbamoylamino)methyl]-N-[(6-pyrrolidin-1-ylpyridin-3-yl)methyl]benzamide Traditional Name: 4-[(isopropylcarbamoylamino)methyl]-N-[(6-pyrrolidino-3-pyridyl)methyl]benzamide Formula: C22H29N5O2 MolecularWeight: 395.49796

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NCC1=CC=C(C=C1)C(=O)NCC2=CN=C(C=C2)N3CCCC3

Isomeric SMILES

CC(C)NC(=O)NCC1=CC=C(C=C1)C(=O)NCC2=CN=C(C=C2)N3CCCC3

InChI

InChI=1S/C22H29N5O2/c1-16(2)26-22(29)25-13-17-5-8-19(9-6-17)21(28)24-15-18-7-10-20(23-14-18)27-11-3-4-12-27/h5-10,14,16H,3-4,11-13,15H2,1-2H3,(H,24,28)(H2,25,26,29)