2-(4,5-diphenyl-1,3-dithiol-1-ium-2-yl)-1,3-bis(4,5-diphenyl-1,3-dithiol-2-ylidene)guanidine

Systemtic Name: 2-(4,5-diphenyl-1,3-dithiol-1-ium-2-yl)-1,3-bis(4,5-diphenyl-1,3-dithiol-2-ylidene)guanidine Openeye Name: 2-(4,5-diphenyl-1,3-dithiol-1-ium-2-yl)-1,3-bis(4,5-diphenyl-1,3-dithiol-2-ylidene)guanidine CAS Name: 2-(4,5-diphenyl-1,3-dithiol-1-ium-2-yl)-1,3-bis(4,5-diphenyl-1,3-dithiol-2-ylidene)guanidine IUPAC Name: 2-(4,5-diphenyl-1,3-dithiol-1-ium-2-yl)-1,3-bis(4,5-diphenyl-1,3-dithiol-2-ylidene)guanidine Traditional Name: 2-(4,5-diphenyl-1,3-dithiol-1-ium-2-yl)-1,3-bis(4,5-diphenyl-1,3-dithiol-2-ylidene)guanidine Formula: C46H30N3S6+ MolecularWeight: 817.1405

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(SC(=NC(=NC3=[S+]C(=C(S3)C4=CC=CC=C4)C5=CC=CC=C5)N=C6SC(=C(S6)C7=CC=CC=C7)C8=CC=CC=C8)S2)C9=CC=CC=C9

Isomeric SMILES

C1=CC=C(C=C1)C2=C(SC(=NC(=NC3=[S+]C(=C(S3)C4=CC=CC=C4)C5=CC=CC=C5)N=C6SC(=C(S6)C7=CC=CC=C7)C8=CC=CC=C8)S2)C9=CC=CC=C9

InChI

InChI=1S/C46H30N3S6/c1-7-19-31(20-8-1)37-38(32-21-9-2-10-22-32)51-44(50-37)47-43(48-45-52-39(33-23-11-3-12-24-33)40(53-45)34-25-13-4-14-26-34)49-46-54-41(35-27-15-5-16-28-35)42(55-46)36-29-17-6-18-30-36/h1-30H/q+1