N-(phenylmethyl)-3-(6-propan-2-yl-2-pyrrolidin-1-yl-pyrimidin-4-yl)-1,2-oxazole-5-carboxamide

Systemtic Name: N-(phenylmethyl)-3-(6-propan-2-yl-2-pyrrolidin-1-yl-pyrimidin-4-yl)-1,2-oxazole-5-carboxamide Openeye Name: N-benzyl-3-(6-isopropyl-2-pyrrolidin-1-yl-pyrimidin-4-yl)isoxazole-5-carboxamide CAS Name: N-(phenylmethyl)-3-[6-propan-2-yl-2-(1-pyrrolidinyl)-4-pyrimidinyl]-5-isoxazolecarboxamide IUPAC Name: N-benzyl-3-(6-propan-2-yl-2-pyrrolidin-1-ylpyrimidin-4-yl)-1,2-oxazole-5-carboxamide Traditional Name: N-benzyl-3-(6-isopropyl-2-pyrrolidino-pyrimidin-4-yl)isoxazole-5-carboxamide Formula: C22H25N5O2 MolecularWeight: 391.4662

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC(=NC(=C1)C2=NOC(=C2)C(=O)NCC3=CC=CC=C3)N4CCCC4

Isomeric SMILES

CC(C)C1=NC(=NC(=C1)C2=NOC(=C2)C(=O)NCC3=CC=CC=C3)N4CCCC4

InChI

InChI=1S/C22H25N5O2/c1-15(2)17-12-18(25-22(24-17)27-10-6-7-11-27)19-13-20(29-26-19)21(28)23-14-16-8-4-3-5-9-16/h3-5,8-9,12-13,15H,6-7,10-11,14H2,1-2H3,(H,23,28)