N-[bis(azepan-1-yl)-tert-butyl-$l^{5}-phosphanylidene]-1-cyclopentyl-2,5-dimethyl-pyrrole-3-carbothioamide

Systemtic Name: N-[bis(azepan-1-yl)-tert-butyl-$l^{5}-phosphanylidene]-1-cyclopentyl-2,5-dimethyl-pyrrole-3-carbothioamide Openeye Name: N-[bis(azepan-1-yl)-tert-butyl-$l^{5}-phosphanylidene]-1-cyclopentyl-2,5-dimethyl-pyrrole-3-carbothioamide CAS Name: N-[bis(1-azepanyl)-tert-butylphosphoranylidene]-1-cyclopentyl-2,5-dimethyl-3-pyrrolecarbothioamide IUPAC Name: N-[bis(azepan-1-yl)-tert-butyl-$l^{5}-phosphanylidene]-1-cyclopentyl-2,5-dimethylpyrrole-3-carbothioamide Traditional Name: N-[bis(azepan-1-yl)-tert-butyl-phosphoranylidene]-1-cyclopentyl-2,5-dimethyl-pyrrole-3-carbothioamide Formula: C28H49N4PS MolecularWeight: 504.754221

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2CCCC2)C)C(=S)N=P(C(C)(C)C)(N3CCCCCC3)N4CCCCCC4

Isomeric SMILES

CC1=CC(=C(N1C2CCCC2)C)C(=S)N=P(C(C)(C)C)(N3CCCCCC3)N4CCCCCC4

InChI

InChI=1S/C28H49N4PS/c1-23-22-26(24(2)32(23)25-16-10-11-17-25)27(34)29-33(28(3,4)5,30-18-12-6-7-13-19-30)31-20-14-8-9-15-21-31/h22,25H,6-21H2,1-5H3