N-(3-methylbutyl)-2-(3-nitrophenyl)-5-thiophen-2-yl-pyrazole-3-carboxamide

Systemtic Name: N-(3-methylbutyl)-2-(3-nitrophenyl)-5-thiophen-2-yl-pyrazole-3-carboxamide Openeye Name: N-isopentyl-2-(3-nitrophenyl)-5-(2-thienyl)pyrazole-3-carboxamide CAS Name: N-(3-methylbutyl)-2-(3-nitrophenyl)-5-thiophen-2-yl-3-pyrazolecarboxamide IUPAC Name: N-(3-methylbutyl)-2-(3-nitrophenyl)-5-thiophen-2-ylpyrazole-3-carboxamide Traditional Name: N-isoamyl-2-(3-nitrophenyl)-5-(2-thienyl)pyrazole-3-carboxamide Formula: C19H20N4O3S MolecularWeight: 384.4521

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20N4O3S/c1-13(2)8-9-20-19(24)17-12-16(18-7-4-10-27-18)21-22(17)14-5-3-6-15(11-14)23(25)26/h3-7,10-13H,8-9H2,1-2H3,(H,20,24)