1-[bis(diethylamino)-pyridin-4-yl-$l^{5}-phosphanylidene]-3-(2-bromophenyl)thiourea

Systemtic Name: 1-[bis(diethylamino)-pyridin-4-yl-$l^{5}-phosphanylidene]-3-(2-bromophenyl)thiourea Openeye Name: 1-[bis(diethylamino)-(4-pyridyl)-$l^{5}-phosphanylidene]-3-(2-bromophenyl)thiourea CAS Name: 1-[bis(diethylamino)-pyridin-4-ylphosphoranylidene]-3-(2-bromophenyl)thiourea IUPAC Name: 1-[bis(diethylamino)-pyridin-4-yl-$l^{5}-phosphanylidene]-3-(2-bromophenyl)thiourea Traditional Name: 1-[bis(diethylamino)-(4-pyridyl)phosphoranylidene]-3-(2-bromophenyl)thiourea Formula: C20H29BrN5PS MolecularWeight: 482.420521

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)P(=NC(=S)NC1=CC=CC=C1Br)(C2=CC=NC=C2)N(CC)CC

Isomeric SMILES

CCN(CC)P(=NC(=S)NC1=CC=CC=C1Br)(C2=CC=NC=C2)N(CC)CC

InChI

InChI=1S/C20H29BrN5PS/c1-5-25(6-2)27(26(7-3)8-4,17-13-15-22-16-14-17)24-20(28)23-19-12-10-9-11-18(19)21/h9-16H,5-8H2,1-4H3,(H,23,28)