N-(2-methoxy-5-morpholin-4-ylsulfonyl-phenyl)-2-(4-nitrophenyl)sulfanyl-propanamide

Systemtic Name: N-(2-methoxy-5-morpholin-4-ylsulfonyl-phenyl)-2-(4-nitrophenyl)sulfanyl-propanamide Openeye Name: N-(2-methoxy-5-morpholinosulfonyl-phenyl)-2-(4-nitrophenyl)sulfanyl-propanamide CAS Name: N-[2-methoxy-5-(4-morpholinylsulfonyl)phenyl]-2-[(4-nitrophenyl)thio]propanamide IUPAC Name: N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-2-(4-nitrophenyl)sulfanylpropanamide Traditional Name: N-(2-methoxy-5-morpholinosulfonyl-phenyl)-2-[(4-nitrophenyl)thio]propionamide Formula: C20H23N3O7S2 MolecularWeight: 481.54252

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=CC(=C1)S(=O)(=O)N2CCOCC2)OC)SC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C(=O)NC1=C(C=CC(=C1)S(=O)(=O)N2CCOCC2)OC)SC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H23N3O7S2/c1-14(31-16-5-3-15(4-6-16)23(25)26)20(24)21-18-13-17(7-8-19(18)29-2)32(27,28)22-9-11-30-12-10-22/h3-8,13-14H,9-12H2,1-2H3,(H,21,24)