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

Systemtic Name: 1-[bis(azepan-1-yl)-tert-butyl-$l^{5}-phosphanylidene]-3-phenyl-thiourea Openeye Name: 1-[bis(azepan-1-yl)-tert-butyl-$l^{5}-phosphanylidene]-3-phenyl-thiourea CAS Name: 1-[bis(1-azepanyl)-tert-butylphosphoranylidene]-3-phenylthiourea IUPAC Name: 1-[bis(azepan-1-yl)-tert-butyl-$l^{5}-phosphanylidene]-3-phenylthiourea Traditional Name: 1-[bis(azepan-1-yl)-tert-butyl-phosphoranylidene]-3-phenyl-thiourea Formula: C23H39N4PS MolecularWeight: 434.621321

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)P(=NC(=S)NC1=CC=CC=C1)(N2CCCCCC2)N3CCCCCC3

Isomeric SMILES

CC(C)(C)P(=NC(=S)NC1=CC=CC=C1)(N2CCCCCC2)N3CCCCCC3

InChI

InChI=1S/C23H39N4PS/c1-23(2,3)28(26-17-11-4-5-12-18-26,27-19-13-6-7-14-20-27)25-22(29)24-21-15-9-8-10-16-21/h8-10,15-16H,4-7,11-14,17-20H2,1-3H3,(H,24,29)