N-(4-methyl-3-morpholin-4-ylsulfonyl-phenyl)-5-nitro-thiophene-2-carboxamide

Systemtic Name: N-(4-methyl-3-morpholin-4-ylsulfonyl-phenyl)-5-nitro-thiophene-2-carboxamide Openeye Name: N-(4-methyl-3-morpholinosulfonyl-phenyl)-5-nitro-thiophene-2-carboxamide CAS Name: N-[4-methyl-3-(4-morpholinylsulfonyl)phenyl]-5-nitro-2-thiophenecarboxamide IUPAC Name: N-(4-methyl-3-morpholin-4-ylsulfonylphenyl)-5-nitrothiophene-2-carboxamide Traditional Name: N-(4-methyl-3-morpholinosulfonyl-phenyl)-5-nitro-thiophene-2-carboxamide Formula: C16H17N3O6S2 MolecularWeight: 411.45268

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CC=C(S2)[N+](=O)[O-])S(=O)(=O)N3CCOCC3

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CC=C(S2)[N+](=O)[O-])S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C16H17N3O6S2/c1-11-2-3-12(17-16(20)13-4-5-15(26-13)19(21)22)10-14(11)27(23,24)18-6-8-25-9-7-18/h2-5,10H,6-9H2,1H3,(H,17,20)