6-[[[4-(azepan-1-ylsulfonyl)phenyl]amino]methylidene]-3-(diethylamino)cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[[[4-(azepan-1-ylsulfonyl)phenyl]amino]methylidene]-3-(diethylamino)cyclohexa-2,4-dien-1-one Openeye Name: 6-[[4-(azepan-1-ylsulfonyl)anilino]methylene]-3-(diethylamino)cyclohexa-2,4-dien-1-one CAS Name: 6-[[4-(1-azepanylsulfonyl)anilino]methylidene]-3-(diethylamino)-1-cyclohexa-2,4-dienone IUPAC Name: 6-[[4-(azepan-1-ylsulfonyl)anilino]methylidene]-3-(diethylamino)cyclohexa-2,4-dien-1-one Traditional Name: 6-[[4-(azepan-1-ylsulfonyl)anilino]methylene]-3-(diethylamino)cyclohexa-2,4-dien-1-one Formula: C23H31N3O3S MolecularWeight: 429.57554

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC(=O)C(=CNC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3)C=C1

Isomeric SMILES

CCN(CC)C1=CC(=O)C(=CNC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3)C=C1

InChI

InChI=1S/C23H31N3O3S/c1-3-25(4-2)21-12-9-19(23(27)17-21)18-24-20-10-13-22(14-11-20)30(28,29)26-15-7-5-6-8-16-26/h9-14,17-18,24H,3-8,15-16H2,1-2H3