3-methyl-N-[[4-(3-oxidanylidenepiperazin-1-yl)phenyl]methyl]-1,2-oxazole-5-carboxamide

Systemtic Name: 3-methyl-N-[[4-(3-oxidanylidenepiperazin-1-yl)phenyl]methyl]-1,2-oxazole-5-carboxamide Openeye Name: 3-methyl-N-[[4-(3-oxopiperazin-1-yl)phenyl]methyl]isoxazole-5-carboxamide CAS Name: 3-methyl-N-[[4-(3-oxo-1-piperazinyl)phenyl]methyl]-5-isoxazolecarboxamide IUPAC Name: 3-methyl-N-[[4-(3-oxopiperazin-1-yl)phenyl]methyl]-1,2-oxazole-5-carboxamide Traditional Name: N-[4-(3-ketopiperazino)benzyl]-3-methyl-isoxazole-5-carboxamide Formula: C16H18N4O3 MolecularWeight: 314.33912

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1)C(=O)NCC2=CC=C(C=C2)N3CCNC(=O)C3

Isomeric SMILES

CC1=NOC(=C1)C(=O)NCC2=CC=C(C=C2)N3CCNC(=O)C3

InChI

InChI=1S/C16H18N4O3/c1-11-8-14(23-19-11)16(22)18-9-12-2-4-13(5-3-12)20-7-6-17-15(21)10-20/h2-5,8H,6-7,9-10H2,1H3,(H,17,21)(H,18,22)