4-[(3E)-2-(4-chlorophenyl)sulfanyl-3-[(2E)-2-(1,3,3-trimethylindol-2-ylidene)ethylidene]cyclohexen-1-yl]-2-ethenyl-1,3,3-trimethyl-indol-1-ium

Systemtic Name: 4-[(3E)-2-(4-chlorophenyl)sulfanyl-3-[(2E)-2-(1,3,3-trimethylindol-2-ylidene)ethylidene]cyclohexen-1-yl]-2-ethenyl-1,3,3-trimethyl-indol-1-ium Openeye Name: 4-[(3E)-2-(4-chlorophenyl)sulfanyl-3-[(2E)-2-(1,3,3-trimethylindolin-2-ylidene)ethylidene]cyclohexen-1-yl]-1,3,3-trimethyl-2-vinyl-indol-1-ium CAS Name: 4-[(3E)-2-[(4-chlorophenyl)thio]-3-[(2E)-2-(1,3,3-trimethyl-2-indolylidene)ethylidene]-1-cyclohexenyl]-2-ethenyl-1,3,3-trimethylindol-1-ium IUPAC Name: 4-[(3E)-2-(4-chlorophenyl)sulfanyl-3-[(2E)-2-(1,3,3-trimethylindol-2-ylidene)ethylidene]cyclohexen-1-yl]-2-ethenyl-1,3,3-trimethylindol-1-ium Traditional Name: 4-[(3E)-2-[(4-chlorophenyl)thio]-3-[(2E)-2-(1,3,3-trimethylindolin-2-ylidene)ethylidene]cyclohexen-1-yl]-1,3,3-trimethyl-2-vinyl-indol-1-ium Formula: C38H40ClN2S+ MolecularWeight: 592.2556

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=CC=CC=C2N(C1=CC=C3CCCC(=C3SC4=CC=C(C=C4)Cl)C5=C6C(=CC=C5)[N+](=C(C6(C)C)C=C)C)C)C

Isomeric SMILES

CC\1(C2=CC=CC=C2N(/C1=C/C=C/3\CCCC(=C3SC4=CC=C(C=C4)Cl)C5=C6C(=CC=C5)[N+](=C(C6(C)C)C=C)C)C)C

InChI

InChI=1S/C38H40ClN2S/c1-8-33-38(4,5)35-28(14-12-18-32(35)41(33)7)29-15-11-13-25(36(29)42-27-22-20-26(39)21-23-27)19-24-34-37(2,3)30-16-9-10-17-31(30)40(34)6/h8-10,12,14,16-24H,1,11,13,15H2,2-7H3/q+1/b25-19+,34-24+