N-[3-methyl-1-oxidanylidene-1-(pyridin-3-ylmethylamino)butan-2-yl]-5-(1-methylpyrrol-2-yl)-1,2-oxazole-3-carboxamide

Systemtic Name: N-[3-methyl-1-oxidanylidene-1-(pyridin-3-ylmethylamino)butan-2-yl]-5-(1-methylpyrrol-2-yl)-1,2-oxazole-3-carboxamide Openeye Name: N-[2-methyl-1-(3-pyridylmethylcarbamoyl)propyl]-5-(1-methylpyrrol-2-yl)isoxazole-3-carboxamide CAS Name: N-[3-methyl-1-oxo-1-(3-pyridinylmethylamino)butan-2-yl]-5-(1-methyl-2-pyrrolyl)-3-isoxazolecarboxamide IUPAC Name: N-[3-methyl-1-oxo-1-(pyridin-3-ylmethylamino)butan-2-yl]-5-(1-methylpyrrol-2-yl)-1,2-oxazole-3-carboxamide Traditional Name: N-[2-methyl-1-(3-pyridylmethylcarbamoyl)propyl]-5-(1-methylpyrrol-2-yl)isoxazole-3-carboxamide Formula: C20H23N5O3 MolecularWeight: 381.42832

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NCC1=CN=CC=C1)NC(=O)C2=NOC(=C2)C3=CC=CN3C

Isomeric SMILES

CC(C)C(C(=O)NCC1=CN=CC=C1)NC(=O)C2=NOC(=C2)C3=CC=CN3C

InChI

InChI=1S/C20H23N5O3/c1-13(2)18(20(27)22-12-14-6-4-8-21-11-14)23-19(26)15-10-17(28-24-15)16-7-5-9-25(16)3/h4-11,13,18H,12H2,1-3H3,(H,22,27)(H,23,26)