N-(2-methoxy-5-morpholin-4-ylsulfonyl-phenyl)-4-phenylsulfanyl-butanamide

Systemtic Name: N-(2-methoxy-5-morpholin-4-ylsulfonyl-phenyl)-4-phenylsulfanyl-butanamide Openeye Name: N-(2-methoxy-5-morpholinosulfonyl-phenyl)-4-phenylsulfanyl-butanamide CAS Name: N-[2-methoxy-5-(4-morpholinylsulfonyl)phenyl]-4-(phenylthio)butanamide IUPAC Name: N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-4-phenylsulfanylbutanamide Traditional Name: N-(2-methoxy-5-morpholinosulfonyl-phenyl)-4-(phenylthio)butyramide Formula: C21H26N2O5S2 MolecularWeight: 450.57154

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)NC(=O)CCCSC3=CC=CC=C3

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)NC(=O)CCCSC3=CC=CC=C3

InChI

InChI=1S/C21H26N2O5S2/c1-27-20-10-9-18(30(25,26)23-11-13-28-14-12-23)16-19(20)22-21(24)8-5-15-29-17-6-3-2-4-7-17/h2-4,6-7,9-10,16H,5,8,11-15H2,1H3,(H,22,24)