N-(3-cyanothiophen-2-yl)-2-(4-morpholin-4-ylsulfonyl-2-nitro-phenoxy)ethanamide

Systemtic Name: N-(3-cyanothiophen-2-yl)-2-(4-morpholin-4-ylsulfonyl-2-nitro-phenoxy)ethanamide Openeye Name: N-(3-cyano-2-thienyl)-2-(4-morpholinosulfonyl-2-nitro-phenoxy)acetamide CAS Name: N-(3-cyano-2-thiophenyl)-2-[4-(4-morpholinylsulfonyl)-2-nitrophenoxy]acetamide IUPAC Name: N-(3-cyanothiophen-2-yl)-2-(4-morpholin-4-ylsulfonyl-2-nitrophenoxy)acetamide Traditional Name: N-(3-cyano-2-thienyl)-2-(4-morpholinosulfonyl-2-nitro-phenoxy)acetamide Formula: C17H16N4O7S2 MolecularWeight: 452.46154

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC(=C(C=C2)OCC(=O)NC3=C(C=CS3)C#N)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC(=C(C=C2)OCC(=O)NC3=C(C=CS3)C#N)[N+](=O)[O-]

InChI

InChI=1S/C17H16N4O7S2/c18-10-12-3-8-29-17(12)19-16(22)11-28-15-2-1-13(9-14(15)21(23)24)30(25,26)20-4-6-27-7-5-20/h1-3,8-9H,4-7,11H2,(H,19,22)