N-[2-[2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)ethanoylamino]ethyl]thiophene-2-carboxamide

Systemtic Name: N-[2-[2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)ethanoylamino]ethyl]thiophene-2-carboxamide Openeye Name: N-[2-[[2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)acetyl]amino]ethyl]thiophene-2-carboxamide CAS Name: N-[2-[[2-(3,5-dimethyl-4-nitro-1-pyrazolyl)-1-oxoethyl]amino]ethyl]-2-thiophenecarboxamide IUPAC Name: N-[2-[[2-(3,5-dimethyl-4-nitropyrazol-1-yl)acetyl]amino]ethyl]thiophene-2-carboxamide Traditional Name: N-[2-[[2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)acetyl]amino]ethyl]thiophene-2-carboxamide Formula: C14H17N5O4S MolecularWeight: 351.38088

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(=O)NCCNC(=O)C2=CC=CS2)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC(=O)NCCNC(=O)C2=CC=CS2)C)[N+](=O)[O-]

InChI

InChI=1S/C14H17N5O4S/c1-9-13(19(22)23)10(2)18(17-9)8-12(20)15-5-6-16-14(21)11-4-3-7-24-11/h3-4,7H,5-6,8H2,1-2H3,(H,15,20)(H,16,21)