6-[[(4-methyl-3-morpholin-4-ylsulfonyl-phenyl)amino]methylidene]-3-propoxy-cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[[(4-methyl-3-morpholin-4-ylsulfonyl-phenyl)amino]methylidene]-3-propoxy-cyclohexa-2,4-dien-1-one Openeye Name: 6-[(4-methyl-3-morpholinosulfonyl-anilino)methylene]-3-propoxy-cyclohexa-2,4-dien-1-one CAS Name: 6-[[4-methyl-3-(4-morpholinylsulfonyl)anilino]methylidene]-3-propoxy-1-cyclohexa-2,4-dienone IUPAC Name: 6-[(4-methyl-3-morpholin-4-ylsulfonylanilino)methylidene]-3-propoxycyclohexa-2,4-dien-1-one Traditional Name: 6-[(4-methyl-3-morpholinosulfonyl-anilino)methylene]-3-propoxy-cyclohexa-2,4-dien-1-one Formula: C21H26N2O5S MolecularWeight: 418.50654

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC(=O)C(=CNC2=CC(=C(C=C2)C)S(=O)(=O)N3CCOCC3)C=C1

Isomeric SMILES

CCCOC1=CC(=O)C(=CNC2=CC(=C(C=C2)C)S(=O)(=O)N3CCOCC3)C=C1

InChI

InChI=1S/C21H26N2O5S/c1-3-10-28-19-7-5-17(20(24)14-19)15-22-18-6-4-16(2)21(13-18)29(25,26)23-8-11-27-12-9-23/h4-7,13-15,22H,3,8-12H2,1-2H3