3-[2-(cyclopropylmethylamino)-6-methyl-pyrimidin-4-yl]-N-(phenylmethyl)-1,2-oxazole-5-carboxamide

Systemtic Name: 3-[2-(cyclopropylmethylamino)-6-methyl-pyrimidin-4-yl]-N-(phenylmethyl)-1,2-oxazole-5-carboxamide Openeye Name: N-benzyl-3-[2-(cyclopropylmethylamino)-6-methyl-pyrimidin-4-yl]isoxazole-5-carboxamide CAS Name: 3-[2-(cyclopropylmethylamino)-6-methyl-4-pyrimidinyl]-N-(phenylmethyl)-5-isoxazolecarboxamide IUPAC Name: N-benzyl-3-[2-(cyclopropylmethylamino)-6-methylpyrimidin-4-yl]-1,2-oxazole-5-carboxamide Traditional Name: N-benzyl-3-[2-(cyclopropylmethylamino)-6-methyl-pyrimidin-4-yl]isoxazole-5-carboxamide Formula: C20H21N5O2 MolecularWeight: 363.41304

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC(=C1)C2=NOC(=C2)C(=O)NCC3=CC=CC=C3)NCC4CC4

Isomeric SMILES

CC1=NC(=NC(=C1)C2=NOC(=C2)C(=O)NCC3=CC=CC=C3)NCC4CC4

InChI

InChI=1S/C20H21N5O2/c1-13-9-16(24-20(23-13)22-12-15-7-8-15)17-10-18(27-25-17)19(26)21-11-14-5-3-2-4-6-14/h2-6,9-10,15H,7-8,11-12H2,1H3,(H,21,26)(H,22,23,24)