N-[2-[(4-cyanophenyl)amino]-2-(4,5-diethoxy-2-oxidanyl-phenyl)ethyl]propane-1-sulfonamide

Systemtic Name: N-[2-[(4-cyanophenyl)amino]-2-(4,5-diethoxy-2-oxidanyl-phenyl)ethyl]propane-1-sulfonamide Openeye Name: N-[2-(4-cyanoanilino)-2-(4,5-diethoxy-2-hydroxy-phenyl)ethyl]propane-1-sulfonamide CAS Name: N-[2-(4-cyanoanilino)-2-(4,5-diethoxy-2-hydroxyphenyl)ethyl]-1-propanesulfonamide IUPAC Name: N-[2-(4-cyanoanilino)-2-(4,5-diethoxy-2-hydroxyphenyl)ethyl]propane-1-sulfonamide Traditional Name: N-[2-(4-cyanoanilino)-2-(4,5-diethoxy-2-hydroxy-phenyl)ethyl]propane-1-sulfonamide Formula: C22H29N3O5S MolecularWeight: 447.54776

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)NCC(C1=CC(=C(C=C1O)OCC)OCC)NC2=CC=C(C=C2)C#N

Isomeric SMILES

CCCS(=O)(=O)NCC(C1=CC(=C(C=C1O)OCC)OCC)NC2=CC=C(C=C2)C#N

InChI

InChI=1S/C22H29N3O5S/c1-4-11-31(27,28)24-15-19(25-17-9-7-16(14-23)8-10-17)18-12-21(29-5-2)22(30-6-3)13-20(18)26/h7-10,12-13,19,24-26H,4-6,11,15H2,1-3H3