N-[1-adamantyl-bis(dimethylamino)-$l^{5}-phosphanylidene]-4-methyl-piperazin-4-ium-1-carbothioamide

Systemtic Name: N-[1-adamantyl-bis(dimethylamino)-$l^{5}-phosphanylidene]-4-methyl-piperazin-4-ium-1-carbothioamide Openeye Name: N-[1-adamantyl-bis(dimethylamino)-$l^{5}-phosphanylidene]-4-methyl-piperazin-4-ium-1-carbothioamide CAS Name: N-[1-adamantyl-bis(dimethylamino)phosphoranylidene]-4-methyl-1-piperazin-4-iumcarbothioamide IUPAC Name: N-[1-adamantyl-bis(dimethylamino)-$l^{5}-phosphanylidene]-4-methylpiperazin-4-ium-1-carbothioamide Traditional Name: N-[1-adamantyl-bis(dimethylamino)phosphoranylidene]-4-methyl-piperazin-4-ium-1-carbothioamide Formula: C20H39N5PS+ MolecularWeight: 412.595921

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(=S)N=P(C23CC4CC(C2)CC(C4)C3)(N(C)C)N(C)C

Isomeric SMILES

C[NH+]1CCN(CC1)C(=S)N=P(C23CC4CC(C2)CC(C4)C3)(N(C)C)N(C)C

InChI

InChI=1S/C20H38N5PS/c1-22(2)26(23(3)4,21-19(27)25-8-6-24(5)7-9-25)20-13-16-10-17(14-20)12-18(11-16)15-20/h16-18H,6-15H2,1-5H3/p+1