N4,N5-dibutyl-3-[(3-methoxyphenyl)sulfanylmethyl]-1,2-oxazole-4,5-dicarboxamide

Systemtic Name: N4,N5-dibutyl-3-[(3-methoxyphenyl)sulfanylmethyl]-1,2-oxazole-4,5-dicarboxamide Openeye Name: N4,N5-dibutyl-3-[(3-methoxyphenyl)sulfanylmethyl]isoxazole-4,5-dicarboxamide CAS Name: N4,N5-dibutyl-3-[[(3-methoxyphenyl)thio]methyl]isoxazole-4,5-dicarboxamide IUPAC Name: 4-N,5-N-dibutyl-3-[(3-methoxyphenyl)sulfanylmethyl]-1,2-oxazole-4,5-dicarboxamide Traditional Name: N,N'-dibutyl-3-[[(3-methoxyphenyl)thio]methyl]isoxazole-4,5-dicarboxamide Formula: C21H29N3O4S MolecularWeight: 419.53766

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=C(ON=C1CSC2=CC=CC(=C2)OC)C(=O)NCCCC

Isomeric SMILES

CCCCNC(=O)C1=C(ON=C1CSC2=CC=CC(=C2)OC)C(=O)NCCCC

InChI

InChI=1S/C21H29N3O4S/c1-4-6-11-22-20(25)18-17(14-29-16-10-8-9-15(13-16)27-3)24-28-19(18)21(26)23-12-7-5-2/h8-10,13H,4-7,11-12,14H2,1-3H3,(H,22,25)(H,23,26)