2-[[[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]amino]methylidene]-5-thiophen-2-yl-cyclohexane-1,3-dione

Systemtic Name: 2-[[[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]amino]methylidene]-5-thiophen-2-yl-cyclohexane-1,3-dione Openeye Name: 2-[[4-(6-methyl-1,3-benzothiazol-2-yl)anilino]methylene]-5-(2-thienyl)cyclohexane-1,3-dione CAS Name: 2-[[4-(6-methyl-1,3-benzothiazol-2-yl)anilino]methylidene]-5-thiophen-2-ylcyclohexane-1,3-dione IUPAC Name: 2-[[4-(6-methyl-1,3-benzothiazol-2-yl)anilino]methylidene]-5-thiophen-2-ylcyclohexane-1,3-dione Traditional Name: 2-[[4-(6-methyl-1,3-benzothiazol-2-yl)anilino]methylene]-5-(2-thienyl)cyclohexane-1,3-quinone Formula: C25H20N2O2S2 MolecularWeight: 444.5685

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC=C4C(=O)CC(CC4=O)C5=CC=CS5

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC=C4C(=O)CC(CC4=O)C5=CC=CS5

InChI

InChI=1S/C25H20N2O2S2/c1-15-4-9-20-24(11-15)31-25(27-20)16-5-7-18(8-6-16)26-14-19-21(28)12-17(13-22(19)29)23-3-2-10-30-23/h2-11,14,17,26H,12-13H2,1H3