1-[bis(azepan-1-yl)-tert-butyl-$l^{5}-phosphanylidene]-3-(2-methylphenyl)thiourea

Systemtic Name: 1-[bis(azepan-1-yl)-tert-butyl-$l^{5}-phosphanylidene]-3-(2-methylphenyl)thiourea Openeye Name: 1-[bis(azepan-1-yl)-tert-butyl-$l^{5}-phosphanylidene]-3-(o-tolyl)thiourea CAS Name: 1-[bis(1-azepanyl)-tert-butylphosphoranylidene]-3-(2-methylphenyl)thiourea IUPAC Name: 1-[bis(azepan-1-yl)-tert-butyl-$l^{5}-phosphanylidene]-3-(2-methylphenyl)thiourea Traditional Name: 1-[bis(azepan-1-yl)-tert-butyl-phosphoranylidene]-3-(o-tolyl)thiourea Formula: C24H41N4PS MolecularWeight: 448.647901

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=S)N=P(C(C)(C)C)(N2CCCCCC2)N3CCCCCC3

Isomeric SMILES

CC1=CC=CC=C1NC(=S)N=P(C(C)(C)C)(N2CCCCCC2)N3CCCCCC3

InChI

InChI=1S/C24H41N4PS/c1-21-15-9-10-16-22(21)25-23(30)26-29(24(2,3)4,27-17-11-5-6-12-18-27)28-19-13-7-8-14-20-28/h9-10,15-16H,5-8,11-14,17-20H2,1-4H3,(H,25,30)