4-methyl-N-(4-oxidanylidene-2,6-diphenyl-1,4$l^{5}-thiaphosphinin-4-yl)piperazin-4-ium-1-amine

Systemtic Name: 4-methyl-N-(4-oxidanylidene-2,6-diphenyl-1,4$l^{5}-thiaphosphinin-4-yl)piperazin-4-ium-1-amine Openeye Name: 4-methyl-N-(4-oxo-2,6-diphenyl-1,4$l^{5}-thiaphosphinin-4-yl)piperazin-4-ium-1-amine CAS Name: 4-methyl-N-(4-oxo-2,6-diphenyl-1,4$l^{5}-thiaphosphorin-4-yl)-1-piperazin-4-iumamine IUPAC Name: 4-methyl-N-(4-oxo-2,6-diphenyl-1,4$l^{5}-thiaphosphinin-4-yl)piperazin-4-ium-1-amine Traditional Name: (4-keto-2,6-diphenyl-1,4$l^{5}-thiaphosphorin-4-yl)-(4-methylpiperazin-4-ium-1-yl)amine Formula: C21H25N3OPS+ MolecularWeight: 398.481461

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)NP2(=O)C=C(SC(=C2)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C[NH+]1CCN(CC1)NP2(=O)C=C(SC(=C2)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C21H24N3OPS/c1-23-12-14-24(15-13-23)22-26(25)16-20(18-8-4-2-5-9-18)27-21(17-26)19-10-6-3-7-11-19/h2-11,16-17H,12-15H2,1H3,(H,22,25)/p+1