(5-tert-butyl-2-methyl-pyrazol-3-yl)-[2-(4-methoxy-5-nitro-thiophen-3-yl)carbonylpyrazolidin-1-yl]methanone

Systemtic Name: (5-tert-butyl-2-methyl-pyrazol-3-yl)-[2-(4-methoxy-5-nitro-thiophen-3-yl)carbonylpyrazolidin-1-yl]methanone Openeye Name: (5-tert-butyl-2-methyl-pyrazol-3-yl)-[2-(4-methoxy-5-nitro-thiophene-3-carbonyl)pyrazolidin-1-yl]methanone CAS Name: (5-tert-butyl-2-methyl-3-pyrazolyl)-[2-[(4-methoxy-5-nitro-3-thiophenyl)-oxomethyl]-1-pyrazolidinyl]methanone IUPAC Name: (5-tert-butyl-2-methylpyrazol-3-yl)-[2-(4-methoxy-5-nitrothiophene-3-carbonyl)pyrazolidin-1-yl]methanone Traditional Name: (5-tert-butyl-2-methyl-pyrazol-3-yl)-[2-(4-methoxy-5-nitro-thiophene-3-carbonyl)pyrazolidin-1-yl]methanone Formula: C18H23N5O5S MolecularWeight: 421.47072

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(=C1)C(=O)N2CCCN2C(=O)C3=CSC(=C3OC)[N+](=O)[O-])C

Isomeric SMILES

CC(C)(C)C1=NN(C(=C1)C(=O)N2CCCN2C(=O)C3=CSC(=C3OC)[N+](=O)[O-])C

InChI

InChI=1S/C18H23N5O5S/c1-18(2,3)13-9-12(20(4)19-13)16(25)22-8-6-7-21(22)15(24)11-10-29-17(23(26)27)14(11)28-5/h9-10H,6-8H2,1-5H3