2-[[[4-(4-bromophenyl)-1,3-thiazol-2-yl]amino]methylidene]-5,5-dimethyl-cyclohexane-1,3-dione

Systemtic Name: 2-[[[4-(4-bromophenyl)-1,3-thiazol-2-yl]amino]methylidene]-5,5-dimethyl-cyclohexane-1,3-dione Openeye Name: 2-[[[4-(4-bromophenyl)thiazol-2-yl]amino]methylene]-5,5-dimethyl-cyclohexane-1,3-dione CAS Name: 2-[[[4-(4-bromophenyl)-2-thiazolyl]amino]methylidene]-5,5-dimethylcyclohexane-1,3-dione IUPAC Name: 2-[[[4-(4-bromophenyl)-1,3-thiazol-2-yl]amino]methylidene]-5,5-dimethylcyclohexane-1,3-dione Traditional Name: 2-[[[4-(4-bromophenyl)thiazol-2-yl]amino]methylene]-5,5-dimethyl-cyclohexane-1,3-quinone Formula: C18H17BrN2O2S MolecularWeight: 405.30878

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)C(=CNC2=NC(=CS2)C3=CC=C(C=C3)Br)C(=O)C1)C

Isomeric SMILES

CC1(CC(=O)C(=CNC2=NC(=CS2)C3=CC=C(C=C3)Br)C(=O)C1)C

InChI

InChI=1S/C18H17BrN2O2S/c1-18(2)7-15(22)13(16(23)8-18)9-20-17-21-14(10-24-17)11-3-5-12(19)6-4-11/h3-6,9-10H,7-8H2,1-2H3,(H,20,21)