N-[1-adamantyl-bis(dimethylamino)-$l^{5}-phosphanylidene]azepane-1-carbothioamide

Systemtic Name: N-[1-adamantyl-bis(dimethylamino)-$l^{5}-phosphanylidene]azepane-1-carbothioamide Openeye Name: N-[1-adamantyl-bis(dimethylamino)-$l^{5}-phosphanylidene]azepane-1-carbothioamide CAS Name: N-[1-adamantyl-bis(dimethylamino)phosphoranylidene]-1-azepanecarbothioamide IUPAC Name: N-[1-adamantyl-bis(dimethylamino)-$l^{5}-phosphanylidene]azepane-1-carbothioamide Traditional Name: N-[1-adamantyl-bis(dimethylamino)phosphoranylidene]azepane-1-carbothioamide Formula: C21H39N4PS MolecularWeight: 410.599921

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)P(=NC(=S)N1CCCCCC1)(C23CC4CC(C2)CC(C4)C3)N(C)C

Isomeric SMILES

CN(C)P(=NC(=S)N1CCCCCC1)(C23CC4CC(C2)CC(C4)C3)N(C)C

InChI

InChI=1S/C21H39N4PS/c1-23(2)26(24(3)4,22-20(27)25-9-7-5-6-8-10-25)21-14-17-11-18(15-21)13-19(12-17)16-21/h17-19H,5-16H2,1-4H3