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

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[[butan-2-yl(thiophen-2-ylcarbonyl)amino]methyl]-1,2-oxazole-3-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[[sec-butyl(thiophene-2-carbonyl)amino]methyl]isoxazole-3-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[[butan-2-yl-[oxo(thiophen-2-yl)methyl]amino]methyl]-3-isoxazolecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[[butan-2-yl(thiophene-2-carbonyl)amino]methyl]-1,2-oxazole-3-carboxamide Traditional Name: N-piperonyl-5-[[sec-butyl(2-thenoyl)amino]methyl]isoxazole-3-carboxamide Formula: C22H23N3O5S MolecularWeight: 441.50012

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H23N3O5S/c1-3-14(2)25(22(27)20-5-4-8-31-20)12-16-10-17(24-30-16)21(26)23-11-15-6-7-18-19(9-15)29-13-28-18/h4-10,14H,3,11-13H2,1-2H3,(H,23,26)