N-[3-(2-methylpiperidin-1-yl)propyl]-2-(3-nitrophenyl)-5-thiophen-2-yl-pyrazole-3-carboxamide

Systemtic Name: N-[3-(2-methylpiperidin-1-yl)propyl]-2-(3-nitrophenyl)-5-thiophen-2-yl-pyrazole-3-carboxamide Openeye Name: N-[3-(2-methyl-1-piperidyl)propyl]-2-(3-nitrophenyl)-5-(2-thienyl)pyrazole-3-carboxamide CAS Name: N-[3-(2-methyl-1-piperidinyl)propyl]-2-(3-nitrophenyl)-5-thiophen-2-yl-3-pyrazolecarboxamide IUPAC Name: N-[3-(2-methylpiperidin-1-yl)propyl]-2-(3-nitrophenyl)-5-thiophen-2-ylpyrazole-3-carboxamide Traditional Name: N-[3-(2-methylpiperidino)propyl]-2-(3-nitrophenyl)-5-(2-thienyl)pyrazole-3-carboxamide Formula: C23H27N5O3S MolecularWeight: 453.55718

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1CCCNC(=O)C2=CC(=NN2C3=CC(=CC=C3)[N+](=O)[O-])C4=CC=CS4

Isomeric SMILES

CC1CCCCN1CCCNC(=O)C2=CC(=NN2C3=CC(=CC=C3)[N+](=O)[O-])C4=CC=CS4

InChI

InChI=1S/C23H27N5O3S/c1-17-7-2-3-12-26(17)13-6-11-24-23(29)21-16-20(22-10-5-14-32-22)25-27(21)18-8-4-9-19(15-18)28(30)31/h4-5,8-10,14-17H,2-3,6-7,11-13H2,1H3,(H,24,29)