3-chloranyl-N-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]-N-methyl-6-nitro-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]-N-methyl-6-nitro-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]-N-methyl-6-nitro-benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[(1-ethyl-3-methyl-4-pyrazolyl)methyl]-N-methyl-6-nitro-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-[(1-ethyl-3-methylpyrazol-4-yl)methyl]-N-methyl-6-nitro-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]-N-methyl-6-nitro-benzothiophene-2-carboxamide Formula: C17H17ClN4O3S MolecularWeight: 392.85988

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C)CN(C)C(=O)C2=C(C3=C(S2)C=C(C=C3)[N+](=O)[O-])Cl

Isomeric SMILES

CCN1C=C(C(=N1)C)CN(C)C(=O)C2=C(C3=C(S2)C=C(C=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C17H17ClN4O3S/c1-4-21-9-11(10(2)19-21)8-20(3)17(23)16-15(18)13-6-5-12(22(24)25)7-14(13)26-16/h5-7,9H,4,8H2,1-3H3