1-[(4-fluorophenyl)methyl]-3-methyl-N-(2-methyl-3-nitro-phenyl)thieno[2,3-c]pyrazole-5-carboxamide

Systemtic Name: 1-[(4-fluorophenyl)methyl]-3-methyl-N-(2-methyl-3-nitro-phenyl)thieno[2,3-c]pyrazole-5-carboxamide Openeye Name: 1-[(4-fluorophenyl)methyl]-3-methyl-N-(2-methyl-3-nitro-phenyl)thieno[2,3-c]pyrazole-5-carboxamide CAS Name: 1-[(4-fluorophenyl)methyl]-3-methyl-N-(2-methyl-3-nitrophenyl)-5-thieno[2,3-c]pyrazolecarboxamide IUPAC Name: 1-[(4-fluorophenyl)methyl]-3-methyl-N-(2-methyl-3-nitrophenyl)thieno[2,3-c]pyrazole-5-carboxamide Traditional Name: 1-(4-fluorobenzyl)-3-methyl-N-(2-methyl-3-nitro-phenyl)thieno[2,3-c]pyrazole-5-carboxamide Formula: C21H17FN4O3S MolecularWeight: 424.448083

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])NC(=O)C2=CC3=C(S2)N(N=C3C)CC4=CC=C(C=C4)F

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])NC(=O)C2=CC3=C(S2)N(N=C3C)CC4=CC=C(C=C4)F

InChI

InChI=1S/C21H17FN4O3S/c1-12-17(4-3-5-18(12)26(28)29)23-20(27)19-10-16-13(2)24-25(21(16)30-19)11-14-6-8-15(22)9-7-14/h3-10H,11H2,1-2H3,(H,23,27)