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

Systemtic Name: N-(2-dimethylaminoethyl)-2-(3-nitrophenyl)-5-thiophen-2-yl-pyrazole-3-carboxamide Openeye Name: N-(2-dimethylaminoethyl)-2-(3-nitrophenyl)-5-(2-thienyl)pyrazole-3-carboxamide CAS Name: N-(2-dimethylaminoethyl)-2-(3-nitrophenyl)-5-thiophen-2-yl-3-pyrazolecarboxamide IUPAC Name: N-(2-dimethylaminoethyl)-2-(3-nitrophenyl)-5-thiophen-2-ylpyrazole-3-carboxamide Traditional Name: N-(2-dimethylaminoethyl)-2-(3-nitrophenyl)-5-(2-thienyl)pyrazole-3-carboxamide Formula: C18H19N5O3S MolecularWeight: 385.44016

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19N5O3S/c1-21(2)9-8-19-18(24)16-12-15(17-7-4-10-27-17)20-22(16)13-5-3-6-14(11-13)23(25)26/h3-7,10-12H,8-9H2,1-2H3,(H,19,24)