(2S)-1-[4-(3-methylphenoxy)pyrimidin-2-yl]-N-(pyridin-3-ylmethyl)pyrrolidine-2-carboxamide

Systemtic Name: (2S)-1-[4-(3-methylphenoxy)pyrimidin-2-yl]-N-(pyridin-3-ylmethyl)pyrrolidine-2-carboxamide Openeye Name: (2S)-1-[4-(3-methylphenoxy)pyrimidin-2-yl]-N-(3-pyridylmethyl)pyrrolidine-2-carboxamide CAS Name: (2S)-1-[4-(3-methylphenoxy)-2-pyrimidinyl]-N-(3-pyridinylmethyl)-2-pyrrolidinecarboxamide IUPAC Name: (2S)-1-[4-(3-methylphenoxy)pyrimidin-2-yl]-N-(pyridin-3-ylmethyl)pyrrolidine-2-carboxamide Traditional Name: (2S)-1-[4-(3-methylphenoxy)pyrimidin-2-yl]-N-(3-pyridylmethyl)pyrrolidine-2-carboxamide Formula: C22H23N5O2 MolecularWeight: 389.45032

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OC2=NC(=NC=C2)N3CCCC3C(=O)NCC4=CN=CC=C4

Isomeric SMILES

CC1=CC(=CC=C1)OC2=NC(=NC=C2)N3CCC[C@H]3C(=O)NCC4=CN=CC=C4

InChI

InChI=1S/C22H23N5O2/c1-16-5-2-7-18(13-16)29-20-9-11-24-22(26-20)27-12-4-8-19(27)21(28)25-15-17-6-3-10-23-14-17/h2-3,5-7,9-11,13-14,19H,4,8,12,15H2,1H3,(H,25,28)/t19-/m0/s1