N4,N5-dibutyl-3-(pyridin-2-ylsulfanylmethyl)-1,2-oxazole-4,5-dicarboxamide

Systemtic Name: N4,N5-dibutyl-3-(pyridin-2-ylsulfanylmethyl)-1,2-oxazole-4,5-dicarboxamide Openeye Name: N4,N5-dibutyl-3-(2-pyridylsulfanylmethyl)isoxazole-4,5-dicarboxamide CAS Name: N4,N5-dibutyl-3-[(2-pyridinylthio)methyl]isoxazole-4,5-dicarboxamide IUPAC Name: 4-N,5-N-dibutyl-3-(pyridin-2-ylsulfanylmethyl)-1,2-oxazole-4,5-dicarboxamide Traditional Name: N,N'-dibutyl-3-[(2-pyridylthio)methyl]isoxazole-4,5-dicarboxamide Formula: C19H26N4O3S MolecularWeight: 390.49974

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=C(ON=C1CSC2=CC=CC=N2)C(=O)NCCCC

Isomeric SMILES

CCCCNC(=O)C1=C(ON=C1CSC2=CC=CC=N2)C(=O)NCCCC

InChI

InChI=1S/C19H26N4O3S/c1-3-5-10-21-18(24)16-14(13-27-15-9-7-8-12-20-15)23-26-17(16)19(25)22-11-6-4-2/h7-9,12H,3-6,10-11,13H2,1-2H3,(H,21,24)(H,22,25)