N-(furan-2-ylmethyl)-N,3,5-trimethyl-1-[(4-nitrophenyl)methyl]pyrazole-4-sulfonamide

Systemtic Name: N-(furan-2-ylmethyl)-N,3,5-trimethyl-1-[(4-nitrophenyl)methyl]pyrazole-4-sulfonamide Openeye Name: N-(2-furylmethyl)-N,3,5-trimethyl-1-[(4-nitrophenyl)methyl]pyrazole-4-sulfonamide CAS Name: N-(2-furanylmethyl)-N,3,5-trimethyl-1-[(4-nitrophenyl)methyl]-4-pyrazolesulfonamide IUPAC Name: N-(furan-2-ylmethyl)-N,3,5-trimethyl-1-[(4-nitrophenyl)methyl]pyrazole-4-sulfonamide Traditional Name: N-(2-furfuryl)-N,3,5-trimethyl-1-(4-nitrobenzyl)pyrazole-4-sulfonamide Formula: C18H20N4O5S MolecularWeight: 404.4402

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=C(C=C2)[N+](=O)[O-])C)S(=O)(=O)N(C)CC3=CC=CO3

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=C(C=C2)[N+](=O)[O-])C)S(=O)(=O)N(C)CC3=CC=CO3

InChI

InChI=1S/C18H20N4O5S/c1-13-18(28(25,26)20(3)12-17-5-4-10-27-17)14(2)21(19-13)11-15-6-8-16(9-7-15)22(23)24/h4-10H,11-12H2,1-3H3