2-ethenyl-1,3,3-trimethyl-4-[(3E)-2-phenylsulfanyl-3-[(2E)-2-(1,3,3-trimethylindol-2-ylidene)ethylidene]cyclopenten-1-yl]indol-1-ium

Systemtic Name: 2-ethenyl-1,3,3-trimethyl-4-[(3E)-2-phenylsulfanyl-3-[(2E)-2-(1,3,3-trimethylindol-2-ylidene)ethylidene]cyclopenten-1-yl]indol-1-ium Openeye Name: 1,3,3-trimethyl-4-[(3E)-2-phenylsulfanyl-3-[(2E)-2-(1,3,3-trimethylindolin-2-ylidene)ethylidene]cyclopenten-1-yl]-2-vinyl-indol-1-ium CAS Name: 2-ethenyl-1,3,3-trimethyl-4-[(3E)-2-(phenylthio)-3-[(2E)-2-(1,3,3-trimethyl-2-indolylidene)ethylidene]-1-cyclopentenyl]indol-1-ium IUPAC Name: 2-ethenyl-1,3,3-trimethyl-4-[(3E)-2-phenylsulfanyl-3-[(2E)-2-(1,3,3-trimethylindol-2-ylidene)ethylidene]cyclopenten-1-yl]indol-1-ium Traditional Name: 1,3,3-trimethyl-4-[(3E)-2-(phenylthio)-3-[(2E)-2-(1,3,3-trimethylindolin-2-ylidene)ethylidene]cyclopenten-1-yl]-2-vinyl-indol-1-ium Formula: C37H39N2S+ MolecularWeight: 543.78396

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=CC=CC=C2N(C1=CC=C3CCC(=C3SC4=CC=CC=C4)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\CCC(=C3SC4=CC=CC=C4)C5=C6C(=CC=C5)[N+](=C(C6(C)C)C=C)C)C)C

InChI

InChI=1S/C37H39N2S/c1-8-32-37(4,5)34-27(17-14-20-31(34)39(32)7)28-23-21-25(35(28)40-26-15-10-9-11-16-26)22-24-33-36(2,3)29-18-12-13-19-30(29)38(33)6/h8-20,22,24H,1,21,23H2,2-7H3/q+1/b25-22+,33-24+