N-[3-methyl-1-[[2-(4-nitrophenyl)-2-oxidanyl-ethyl]amino]-1-oxidanylidene-butan-2-yl]thiophene-2-carboxamide

Systemtic Name: N-[3-methyl-1-[[2-(4-nitrophenyl)-2-oxidanyl-ethyl]amino]-1-oxidanylidene-butan-2-yl]thiophene-2-carboxamide Openeye Name: N-[1-[[2-hydroxy-2-(4-nitrophenyl)ethyl]carbamoyl]-2-methyl-propyl]thiophene-2-carboxamide CAS Name: N-[1-[[2-hydroxy-2-(4-nitrophenyl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]-2-thiophenecarboxamide IUPAC Name: N-[1-[[2-hydroxy-2-(4-nitrophenyl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]thiophene-2-carboxamide Traditional Name: N-[1-[[2-hydroxy-2-(4-nitrophenyl)ethyl]carbamoyl]-2-methyl-propyl]thiophene-2-carboxamide Formula: C18H21N3O5S MolecularWeight: 391.44144

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NCC(C1=CC=C(C=C1)[N+](=O)[O-])O)NC(=O)C2=CC=CS2

Isomeric SMILES

CC(C)C(C(=O)NCC(C1=CC=C(C=C1)[N+](=O)[O-])O)NC(=O)C2=CC=CS2

InChI

InChI=1S/C18H21N3O5S/c1-11(2)16(20-17(23)15-4-3-9-27-15)18(24)19-10-14(22)12-5-7-13(8-6-12)21(25)26/h3-9,11,14,16,22H,10H2,1-2H3,(H,19,24)(H,20,23)