N-methyl-2-(2-nitrothiophen-3-yl)sulfanyl-N-[(1-phenylpyrazol-4-yl)methyl]ethanamide

Systemtic Name: N-methyl-2-(2-nitrothiophen-3-yl)sulfanyl-N-[(1-phenylpyrazol-4-yl)methyl]ethanamide Openeye Name: N-methyl-2-[(2-nitro-3-thienyl)sulfanyl]-N-[(1-phenylpyrazol-4-yl)methyl]acetamide CAS Name: N-methyl-2-[(2-nitro-3-thiophenyl)thio]-N-[(1-phenyl-4-pyrazolyl)methyl]acetamide IUPAC Name: N-methyl-2-(2-nitrothiophen-3-yl)sulfanyl-N-[(1-phenylpyrazol-4-yl)methyl]acetamide Traditional Name: N-methyl-2-[(2-nitro-3-thienyl)thio]-N-[(1-phenylpyrazol-4-yl)methyl]acetamide Formula: C17H16N4O3S2 MolecularWeight: 388.46394

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CN(N=C1)C2=CC=CC=C2)C(=O)CSC3=C(SC=C3)[N+](=O)[O-]

Isomeric SMILES

CN(CC1=CN(N=C1)C2=CC=CC=C2)C(=O)CSC3=C(SC=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H16N4O3S2/c1-19(16(22)12-26-15-7-8-25-17(15)21(23)24)10-13-9-18-20(11-13)14-5-3-2-4-6-14/h2-9,11H,10,12H2,1H3