3-(1H-benzimidazol-2-ylsulfanylmethyl)-N4,N5-dipropyl-1,2-oxazole-4,5-dicarboxamide

Systemtic Name: 3-(1H-benzimidazol-2-ylsulfanylmethyl)-N4,N5-dipropyl-1,2-oxazole-4,5-dicarboxamide Openeye Name: 3-(1H-benzimidazol-2-ylsulfanylmethyl)-N4,N5-dipropyl-isoxazole-4,5-dicarboxamide CAS Name: 3-[(1H-benzimidazol-2-ylthio)methyl]-N4,N5-dipropylisoxazole-4,5-dicarboxamide IUPAC Name: 3-(1H-benzimidazol-2-ylsulfanylmethyl)-4-N,5-N-dipropyl-1,2-oxazole-4,5-dicarboxamide Traditional Name: 3-[(1H-benzimidazol-2-ylthio)methyl]-N,N'-dipropyl-isoxazole-4,5-dicarboxamide Formula: C19H23N5O3S MolecularWeight: 401.48262

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1=C(ON=C1CSC2=NC3=CC=CC=C3N2)C(=O)NCCC

Isomeric SMILES

CCCNC(=O)C1=C(ON=C1CSC2=NC3=CC=CC=C3N2)C(=O)NCCC

InChI

InChI=1S/C19H23N5O3S/c1-3-9-20-17(25)15-14(24-27-16(15)18(26)21-10-4-2)11-28-19-22-12-7-5-6-8-13(12)23-19/h5-8H,3-4,9-11H2,1-2H3,(H,20,25)(H,21,26)(H,22,23)