N-[5-(diethylamino)pentan-2-yl]-2-(3-nitrophenyl)-5-thiophen-2-yl-pyrazole-3-carboxamide

Systemtic Name: N-[5-(diethylamino)pentan-2-yl]-2-(3-nitrophenyl)-5-thiophen-2-yl-pyrazole-3-carboxamide Openeye Name: N-[4-(diethylamino)-1-methyl-butyl]-2-(3-nitrophenyl)-5-(2-thienyl)pyrazole-3-carboxamide CAS Name: N-[5-(diethylamino)pentan-2-yl]-2-(3-nitrophenyl)-5-thiophen-2-yl-3-pyrazolecarboxamide IUPAC Name: N-[5-(diethylamino)pentan-2-yl]-2-(3-nitrophenyl)-5-thiophen-2-ylpyrazole-3-carboxamide Traditional Name: N-[4-(diethylamino)-1-methyl-butyl]-2-(3-nitrophenyl)-5-(2-thienyl)pyrazole-3-carboxamide Formula: C23H29N5O3S MolecularWeight: 455.57306

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCC(C)NC(=O)C1=CC(=NN1C2=CC(=CC=C2)[N+](=O)[O-])C3=CC=CS3

Isomeric SMILES

CCN(CC)CCCC(C)NC(=O)C1=CC(=NN1C2=CC(=CC=C2)[N+](=O)[O-])C3=CC=CS3

InChI

InChI=1S/C23H29N5O3S/c1-4-26(5-2)13-7-9-17(3)24-23(29)21-16-20(22-12-8-14-32-22)25-27(21)18-10-6-11-19(15-18)28(30)31/h6,8,10-12,14-17H,4-5,7,9,13H2,1-3H3,(H,24,29)