1-(3-nitrophenyl)-N-(1-propylsulfonylpiperidin-4-yl)pyrazole-3-carboxamide

Systemtic Name: 1-(3-nitrophenyl)-N-(1-propylsulfonylpiperidin-4-yl)pyrazole-3-carboxamide Openeye Name: 1-(3-nitrophenyl)-N-(1-propylsulfonyl-4-piperidyl)pyrazole-3-carboxamide CAS Name: 1-(3-nitrophenyl)-N-(1-propylsulfonyl-4-piperidinyl)-3-pyrazolecarboxamide IUPAC Name: 1-(3-nitrophenyl)-N-(1-propylsulfonylpiperidin-4-yl)pyrazole-3-carboxamide Traditional Name: 1-(3-nitrophenyl)-N-(1-propylsulfonyl-4-piperidyl)pyrazole-3-carboxamide Formula: C18H23N5O5S MolecularWeight: 421.47072

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)N1CCC(CC1)NC(=O)C2=NN(C=C2)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CCCS(=O)(=O)N1CCC(CC1)NC(=O)C2=NN(C=C2)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H23N5O5S/c1-2-12-29(27,28)21-9-6-14(7-10-21)19-18(24)17-8-11-22(20-17)15-4-3-5-16(13-15)23(25)26/h3-5,8,11,13-14H,2,6-7,9-10,12H2,1H3,(H,19,24)