3-[4-[4-(diphenylmethyl)piperazin-4-ium-1-yl]carbonylphenyl]-2-sulfanylidene-1,3-thiazolidin-4-one

Systemtic Name: 3-[4-[4-(diphenylmethyl)piperazin-4-ium-1-yl]carbonylphenyl]-2-sulfanylidene-1,3-thiazolidin-4-one Openeye Name: 3-[4-(4-benzhydrylpiperazin-4-ium-1-carbonyl)phenyl]-2-thioxo-thiazolidin-4-one CAS Name: 3-[4-[[4-(diphenylmethyl)-1-piperazin-4-iumyl]-oxomethyl]phenyl]-2-sulfanylidene-4-thiazolidinone IUPAC Name: 3-[4-(4-benzhydrylpiperazin-4-ium-1-carbonyl)phenyl]-2-sulfanylidene-1,3-thiazolidin-4-one Traditional Name: 3-[4-(4-benzhydrylpiperazin-4-ium-1-carbonyl)phenyl]-2-thioxo-thiazolidin-4-one Formula: C27H26N3O2S2+ MolecularWeight: 488.64424

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)C4=CC=C(C=C4)N5C(=O)CSC5=S

Isomeric SMILES

C1CN(CC[NH+]1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)C4=CC=C(C=C4)N5C(=O)CSC5=S

InChI

InChI=1S/C27H25N3O2S2/c31-24-19-34-27(33)30(24)23-13-11-22(12-14-23)26(32)29-17-15-28(16-18-29)25(20-7-3-1-4-8-20)21-9-5-2-6-10-21/h1-14,25H,15-19H2/p+1