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

Systemtic Name: 2-chloroethyl-[4-[2-(2,6-ditert-butylthiopyran-4-ylidene)ethylidene]cyclohexa-2,5-dien-1-ylidene]-ethyl-azanium Openeye Name: 2-chloroethyl-[4-[2-(2,6-ditert-butylthiopyran-4-ylidene)ethylidene]cyclohexa-2,5-dien-1-ylidene]-ethyl-ammonium CAS Name: 2-chloroethyl-[4-[2-(2,6-ditert-butyl-4-thiopyranylidene)ethylidene]-1-cyclohexa-2,5-dienylidene]-ethylammonium IUPAC Name: 2-chloroethyl-[4-[2-(2,6-ditert-butylthiopyran-4-ylidene)ethylidene]cyclohexa-2,5-dien-1-ylidene]-ethylazanium Traditional Name: 2-chloroethyl-[4-[2-(2,6-ditert-butylthiopyran-4-ylidene)ethylidene]cyclohexa-2,5-dien-1-ylidene]-ethyl-ammonium Formula: C25H35ClNS+ MolecularWeight: 417.0701

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+](=C1C=CC(=CC=C2C=C(SC(=C2)C(C)(C)C)C(C)(C)C)C=C1)CCCl

Isomeric SMILES

CC[N+](=C1C=CC(=CC=C2C=C(SC(=C2)C(C)(C)C)C(C)(C)C)C=C1)CCCl

InChI

InChI=1S/C25H35ClNS/c1-8-27(16-15-26)21-13-11-19(12-14-21)9-10-20-17-22(24(2,3)4)28-23(18-20)25(5,6)7/h9-14,17-18H,8,15-16H2,1-7H3/q+1