2-cyanoethyl-[4-[2-(2,6-ditert-butylthiopyran-4-ylidene)ethylidene]cyclohexa-2,5-dien-1-ylidene]-methyl-azanium

Systemtic Name: 2-cyanoethyl-[4-[2-(2,6-ditert-butylthiopyran-4-ylidene)ethylidene]cyclohexa-2,5-dien-1-ylidene]-methyl-azanium Openeye Name: 2-cyanoethyl-[4-[2-(2,6-ditert-butylthiopyran-4-ylidene)ethylidene]cyclohexa-2,5-dien-1-ylidene]-methyl-ammonium CAS Name: 2-cyanoethyl-[4-[2-(2,6-ditert-butyl-4-thiopyranylidene)ethylidene]-1-cyclohexa-2,5-dienylidene]-methylammonium IUPAC Name: 2-cyanoethyl-[4-[2-(2,6-ditert-butylthiopyran-4-ylidene)ethylidene]cyclohexa-2,5-dien-1-ylidene]-methylazanium Traditional Name: 2-cyanoethyl-[4-[2-(2,6-ditert-butylthiopyran-4-ylidene)ethylidene]cyclohexa-2,5-dien-1-ylidene]-methyl-ammonium Formula: C25H33N2S+ MolecularWeight: 393.60792

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC=C2C=CC(=[N+](C)CCC#N)C=C2)C=C(S1)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC(=CC=C2C=CC(=[N+](C)CCC#N)C=C2)C=C(S1)C(C)(C)C

InChI

InChI=1S/C25H33N2S/c1-24(2,3)22-17-20(18-23(28-22)25(4,5)6)10-9-19-11-13-21(14-12-19)27(7)16-8-15-26/h9-14,17-18H,8,16H2,1-7H3/q+1