2-[3-(1,3-benzothiazol-2-ylmethylidene)-5,5-dimethyl-cyclohexen-1-yl]-N-ethyl-1-phenylsulfanyl-ethenamine

Systemtic Name: 2-[3-(1,3-benzothiazol-2-ylmethylidene)-5,5-dimethyl-cyclohexen-1-yl]-N-ethyl-1-phenylsulfanyl-ethenamine Openeye Name: 2-[3-(1,3-benzothiazol-2-ylmethylene)-5,5-dimethyl-cyclohexen-1-yl]-N-ethyl-1-phenylsulfanyl-ethenamine CAS Name: 2-[3-(1,3-benzothiazol-2-ylmethylidene)-5,5-dimethyl-1-cyclohexenyl]-N-ethyl-1-(phenylthio)ethenamine IUPAC Name: 2-[3-(1,3-benzothiazol-2-ylmethylidene)-5,5-dimethylcyclohexen-1-yl]-N-ethyl-1-phenylsulfanylethenamine Traditional Name: [2-[3-(1,3-benzothiazol-2-ylmethylene)-5,5-dimethyl-cyclohexen-1-yl]-1-(phenylthio)vinyl]-ethyl-amine Formula: C26H28N2S2 MolecularWeight: 432.64392

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCNC(=CC1=CC(=CC2=NC3=CC=CC=C3S2)CC(C1)(C)C)SC4=CC=CC=C4

Isomeric SMILES

CCNC(=CC1=CC(=CC2=NC3=CC=CC=C3S2)CC(C1)(C)C)SC4=CC=CC=C4

InChI

InChI=1S/C26H28N2S2/c1-4-27-24(29-21-10-6-5-7-11-21)15-19-14-20(18-26(2,3)17-19)16-25-28-22-12-8-9-13-23(22)30-25/h5-16,27H,4,17-18H2,1-3H3