N-(1,3-benzodioxol-5-ylmethyl)-5-[[pentan-3-yl(thiophen-2-ylcarbonyl)amino]methyl]-1,2-oxazole-3-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[[pentan-3-yl(thiophen-2-ylcarbonyl)amino]methyl]-1,2-oxazole-3-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[[1-ethylpropyl(thiophene-2-carbonyl)amino]methyl]isoxazole-3-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[[[oxo(thiophen-2-yl)methyl]-pentan-3-ylamino]methyl]-3-isoxazolecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[[pentan-3-yl(thiophene-2-carbonyl)amino]methyl]-1,2-oxazole-3-carboxamide Traditional Name: 5-[[1-ethylpropyl(2-thenoyl)amino]methyl]-N-piperonyl-isoxazole-3-carboxamide Formula: C23H25N3O5S MolecularWeight: 455.5267

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)N(CC1=CC(=NO1)C(=O)NCC2=CC3=C(C=C2)OCO3)C(=O)C4=CC=CS4

Isomeric SMILES

CCC(CC)N(CC1=CC(=NO1)C(=O)NCC2=CC3=C(C=C2)OCO3)C(=O)C4=CC=CS4

InChI

InChI=1S/C23H25N3O5S/c1-3-16(4-2)26(23(28)21-6-5-9-32-21)13-17-11-18(25-31-17)22(27)24-12-15-7-8-19-20(10-15)30-14-29-19/h5-11,16H,3-4,12-14H2,1-2H3,(H,24,27)