N-(4,5-dimethyl-2-nitro-phenyl)-2-[[(2R)-oxolan-2-yl]methyl-(thiophen-2-ylmethyl)amino]ethanamide

Systemtic Name: N-(4,5-dimethyl-2-nitro-phenyl)-2-[[(2R)-oxolan-2-yl]methyl-(thiophen-2-ylmethyl)amino]ethanamide Openeye Name: N-(4,5-dimethyl-2-nitro-phenyl)-2-[[(2R)-tetrahydrofuran-2-yl]methyl-(2-thienylmethyl)amino]acetamide CAS Name: N-(4,5-dimethyl-2-nitrophenyl)-2-[[(2R)-2-oxolanyl]methyl-(thiophen-2-ylmethyl)amino]acetamide IUPAC Name: N-(4,5-dimethyl-2-nitrophenyl)-2-[[(2R)-oxolan-2-yl]methyl-(thiophen-2-ylmethyl)amino]acetamide Traditional Name: N-(4,5-dimethyl-2-nitro-phenyl)-2-[[(2R)-tetrahydrofuran-2-yl]methyl-(2-thenyl)amino]acetamide Formula: C20H25N3O4S MolecularWeight: 403.4952

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C)[N+](=O)[O-])NC(=O)CN(CC2CCCO2)CC3=CC=CS3

Isomeric SMILES

CC1=CC(=C(C=C1C)[N+](=O)[O-])NC(=O)CN(C[C@H]2CCCO2)CC3=CC=CS3

InChI

InChI=1S/C20H25N3O4S/c1-14-9-18(19(23(25)26)10-15(14)2)21-20(24)13-22(11-16-5-3-7-27-16)12-17-6-4-8-28-17/h4,6,8-10,16H,3,5,7,11-13H2,1-2H3,(H,21,24)/t16-/m1/s1