4-methylsulfanyl-3-nitro-N-[2-(oxolan-2-ylmethylcarbamoyl)phenyl]benzamide

Systemtic Name: 4-methylsulfanyl-3-nitro-N-[2-(oxolan-2-ylmethylcarbamoyl)phenyl]benzamide Openeye Name: 4-methylsulfanyl-3-nitro-N-[2-(tetrahydrofuran-2-ylmethylcarbamoyl)phenyl]benzamide CAS Name: 4-(methylthio)-3-nitro-N-[2-[oxo-(2-oxolanylmethylamino)methyl]phenyl]benzamide IUPAC Name: 4-methylsulfanyl-3-nitro-N-[2-(oxolan-2-ylmethylcarbamoyl)phenyl]benzamide Traditional Name: 4-(methylthio)-3-nitro-N-[2-(tetrahydrofurfurylcarbamoyl)phenyl]benzamide Formula: C20H21N3O5S MolecularWeight: 415.46284

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=C(C=C1)C(=O)NC2=CC=CC=C2C(=O)NCC3CCCO3)[N+](=O)[O-]

Isomeric SMILES

CSC1=C(C=C(C=C1)C(=O)NC2=CC=CC=C2C(=O)NCC3CCCO3)[N+](=O)[O-]

InChI

InChI=1S/C20H21N3O5S/c1-29-18-9-8-13(11-17(18)23(26)27)19(24)22-16-7-3-2-6-15(16)20(25)21-12-14-5-4-10-28-14/h2-3,6-9,11,14H,4-5,10,12H2,1H3,(H,21,25)(H,22,24)