[4-(diphenylmethyl)piperazin-4-ium-1-yl]-(4-methylsulfanylphenyl)methanethione

Systemtic Name: [4-(diphenylmethyl)piperazin-4-ium-1-yl]-(4-methylsulfanylphenyl)methanethione Openeye Name: (4-benzhydrylpiperazin-4-ium-1-yl)-(4-methylsulfanylphenyl)methanethione CAS Name: [4-(diphenylmethyl)-1-piperazin-4-iumyl]-[4-(methylthio)phenyl]methanethione IUPAC Name: (4-benzhydrylpiperazin-4-ium-1-yl)-(4-methylsulfanylphenyl)methanethione Traditional Name: (4-benzhydrylpiperazin-4-ium-1-yl)-[4-(methylthio)phenyl]methanethione Formula: C25H27N2S2+ MolecularWeight: 419.62528

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C(=S)N2CC[NH+](CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CSC1=CC=C(C=C1)C(=S)N2CC[NH+](CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H26N2S2/c1-29-23-14-12-22(13-15-23)25(28)27-18-16-26(17-19-27)24(20-8-4-2-5-9-20)21-10-6-3-7-11-21/h2-15,24H,16-19H2,1H3/p+1