5,5-dimethyl-3-[[4-(5-methyl-1,3-benzothiazol-2-yl)phenyl]amino]cyclohex-2-en-1-one

Systemtic Name: 5,5-dimethyl-3-[[4-(5-methyl-1,3-benzothiazol-2-yl)phenyl]amino]cyclohex-2-en-1-one Openeye Name: 5,5-dimethyl-3-[4-(5-methyl-1,3-benzothiazol-2-yl)anilino]cyclohex-2-en-1-one CAS Name: 5,5-dimethyl-3-[4-(5-methyl-1,3-benzothiazol-2-yl)anilino]-1-cyclohex-2-enone IUPAC Name: 5,5-dimethyl-3-[4-(5-methyl-1,3-benzothiazol-2-yl)anilino]cyclohex-2-en-1-one Traditional Name: 5,5-dimethyl-3-[4-(5-methyl-1,3-benzothiazol-2-yl)anilino]cyclohex-2-en-1-one Formula: C22H22N2OS MolecularWeight: 362.48788

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)SC(=N2)C3=CC=C(C=C3)NC4=CC(=O)CC(C4)(C)C

Isomeric SMILES

CC1=CC2=C(C=C1)SC(=N2)C3=CC=C(C=C3)NC4=CC(=O)CC(C4)(C)C

InChI

InChI=1S/C22H22N2OS/c1-14-4-9-20-19(10-14)24-21(26-20)15-5-7-16(8-6-15)23-17-11-18(25)13-22(2,3)12-17/h4-11,23H,12-13H2,1-3H3