4-[2-isothiocyanato-4-(3-isothiocyanato-4-morpholin-4-yl-phenyl)sulfonyl-phenyl]morpholine

Systemtic Name: 4-[2-isothiocyanato-4-(3-isothiocyanato-4-morpholin-4-yl-phenyl)sulfonyl-phenyl]morpholine Openeye Name: 4-[2-isothiocyanato-4-(3-isothiocyanato-4-morpholino-phenyl)sulfonyl-phenyl]morpholine CAS Name: 4-[2-isothiocyanato-4-[3-isothiocyanato-4-(4-morpholinyl)phenyl]sulfonylphenyl]morpholine IUPAC Name: 4-[2-isothiocyanato-4-(3-isothiocyanato-4-morpholin-4-ylphenyl)sulfonylphenyl]morpholine Traditional Name: 4-[2-isothiocyanato-4-(3-isothiocyanato-4-morpholino-phenyl)sulfonyl-phenyl]morpholine Formula: C22H22N4O4S3 MolecularWeight: 502.62948

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2)S(=O)(=O)C3=CC(=C(C=C3)N4CCOCC4)N=C=S)N=C=S

Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2)S(=O)(=O)C3=CC(=C(C=C3)N4CCOCC4)N=C=S)N=C=S

InChI

InChI=1S/C22H22N4O4S3/c27-33(28,17-1-3-21(19(13-17)23-15-31)25-5-9-29-10-6-25)18-2-4-22(20(14-18)24-16-32)26-7-11-30-12-8-26/h1-4,13-14H,5-12H2