N-[(E)-(4-dipyridin-4-ylphosphinothioyloxy-3-methoxy-phenyl)methylideneamino]-1,3-benzothiazol-2-amine

Systemtic Name: N-[(E)-(4-dipyridin-4-ylphosphinothioyloxy-3-methoxy-phenyl)methylideneamino]-1,3-benzothiazol-2-amine Openeye Name: N-[(E)-[4-[bis(4-pyridyl)phosphinothioyloxy]-3-methoxy-phenyl]methyleneamino]-1,3-benzothiazol-2-amine CAS Name: N-[(E)-(4-dipyridin-4-ylphosphinothioyloxy-3-methoxyphenyl)methylideneamino]-1,3-benzothiazol-2-amine IUPAC Name: N-[(E)-(4-dipyridin-4-ylphosphinothioyloxy-3-methoxyphenyl)methylideneamino]-1,3-benzothiazol-2-amine Traditional Name: 1,3-benzothiazol-2-yl-[(E)-[4-[bis(4-pyridyl)thiophosphoryloxy]-3-methoxy-benzylidene]amino]amine Formula: C25H20N5O2PS2 MolecularWeight: 517.562361

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=NNC2=NC3=CC=CC=C3S2)OP(=S)(C4=CC=NC=C4)C5=CC=NC=C5

Isomeric SMILES

COC1=C(C=CC(=C1)/C=N/NC2=NC3=CC=CC=C3S2)OP(=S)(C4=CC=NC=C4)C5=CC=NC=C5

InChI

InChI=1S/C25H20N5O2PS2/c1-31-23-16-18(17-28-30-25-29-21-4-2-3-5-24(21)35-25)6-7-22(23)32-33(34,19-8-12-26-13-9-19)20-10-14-27-15-11-20/h2-17H,1H3,(H,29,30)/b28-17+