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

Systemtic Name: 1-[bis(azepan-1-yl)-tert-butyl-$l^{5}-phosphanylidene]-3-(3-methoxyphenyl)thiourea Openeye Name: 1-[bis(azepan-1-yl)-tert-butyl-$l^{5}-phosphanylidene]-3-(3-methoxyphenyl)thiourea CAS Name: 1-[bis(1-azepanyl)-tert-butylphosphoranylidene]-3-(3-methoxyphenyl)thiourea IUPAC Name: 1-[bis(azepan-1-yl)-tert-butyl-$l^{5}-phosphanylidene]-3-(3-methoxyphenyl)thiourea Traditional Name: 1-[bis(azepan-1-yl)-tert-butyl-phosphoranylidene]-3-(3-methoxyphenyl)thiourea Formula: C24H41N4OPS MolecularWeight: 464.647301

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H41N4OPS/c1-24(2,3)30(27-16-9-5-6-10-17-27,28-18-11-7-8-12-19-28)26-23(31)25-21-14-13-15-22(20-21)29-4/h13-15,20H,5-12,16-19H2,1-4H3,(H,25,31)