1-(tert-butyl-morpholin-4-yl-phenyl-$l^{5}-phosphanylidene)-3-(4-iodanyl-2-methyl-phenyl)thiourea

Systemtic Name: 1-(tert-butyl-morpholin-4-yl-phenyl-$l^{5}-phosphanylidene)-3-(4-iodanyl-2-methyl-phenyl)thiourea Openeye Name: 1-(tert-butyl-morpholino-phenyl-$l^{5}-phosphanylidene)-3-(4-iodo-2-methyl-phenyl)thiourea CAS Name: 1-[tert-butyl-(4-morpholinyl)-phenylphosphoranylidene]-3-(4-iodo-2-methylphenyl)thiourea IUPAC Name: 1-(tert-butyl-morpholin-4-yl-phenyl-$l^{5}-phosphanylidene)-3-(4-iodo-2-methylphenyl)thiourea Traditional Name: 1-(tert-butyl-morpholino-phenyl-phosphoranylidene)-3-(4-iodo-2-methyl-phenyl)thiourea Formula: C22H29IN3OPS MolecularWeight: 541.428391

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)I)NC(=S)N=P(C2=CC=CC=C2)(C(C)(C)C)N3CCOCC3

Isomeric SMILES

CC1=C(C=CC(=C1)I)NC(=S)N=P(C2=CC=CC=C2)(C(C)(C)C)N3CCOCC3

InChI

InChI=1S/C22H29IN3OPS/c1-17-16-18(23)10-11-20(17)24-21(29)25-28(22(2,3)4,19-8-6-5-7-9-19)26-12-14-27-15-13-26/h5-11,16H,12-15H2,1-4H3,(H,24,29)