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

Systemtic Name: 3-[(3-methoxyphenyl)sulfanylmethyl]-N4,N5-dipropyl-1,2-oxazole-4,5-dicarboxamide Openeye Name: 3-[(3-methoxyphenyl)sulfanylmethyl]-N4,N5-dipropyl-isoxazole-4,5-dicarboxamide CAS Name: 3-[[(3-methoxyphenyl)thio]methyl]-N4,N5-dipropylisoxazole-4,5-dicarboxamide IUPAC Name: 3-[(3-methoxyphenyl)sulfanylmethyl]-4-N,5-N-dipropyl-1,2-oxazole-4,5-dicarboxamide Traditional Name: 3-[[(3-methoxyphenyl)thio]methyl]-N,N'-dipropyl-isoxazole-4,5-dicarboxamide Formula: C19H25N3O4S MolecularWeight: 391.4845

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1=C(ON=C1CSC2=CC=CC(=C2)OC)C(=O)NCCC

Isomeric SMILES

CCCNC(=O)C1=C(ON=C1CSC2=CC=CC(=C2)OC)C(=O)NCCC

InChI

InChI=1S/C19H25N3O4S/c1-4-9-20-18(23)16-15(22-26-17(16)19(24)21-10-5-2)12-27-14-8-6-7-13(11-14)25-3/h6-8,11H,4-5,9-10,12H2,1-3H3,(H,20,23)(H,21,24)