3,5-dimethyl-1-phenyl-4-(6-sulfanylidene-2,5,7,10-tetraoxa-6$l^{5}-phosphabicyclo[9.4.0]pentadeca-1(15),11,13-trien-6-yl)pyrazole

Systemtic Name: 3,5-dimethyl-1-phenyl-4-(6-sulfanylidene-2,5,7,10-tetraoxa-6$l^{5}-phosphabicyclo[9.4.0]pentadeca-1(15),11,13-trien-6-yl)pyrazole Openeye Name: 3,5-dimethyl-1-phenyl-4-(6-thioxo-2,5,7,10-tetraoxa-6$l^{5}-phosphabicyclo[9.4.0]pentadeca-1(15),11,13-trien-6-yl)pyrazole CAS Name: 3,5-dimethyl-1-phenyl-4-(6-sulfanylidene-2,5,7,10-tetraoxa-6$l^{5}-phosphabicyclo[9.4.0]pentadeca-1(15),11,13-trien-6-yl)pyrazole IUPAC Name: 3,5-dimethyl-1-phenyl-4-(6-sulfanylidene-2,5,7,10-tetraoxa-6$l^{5}-phosphabicyclo[9.4.0]pentadeca-1(15),11,13-trien-6-yl)pyrazole Traditional Name: 3,5-dimethyl-1-phenyl-4-(6-thioxo-2,5,7,10-tetraoxa-6$l^{5}-phosphabicyclo[9.4.0]pentadeca-1(15),11,13-trien-6-yl)pyrazole Formula: C21H23N2O4PS MolecularWeight: 430.457081

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)P3(=S)OCCOC4=CC=CC=C4OCCO3

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)P3(=S)OCCOC4=CC=CC=C4OCCO3

InChI

InChI=1S/C21H23N2O4PS/c1-16-21(17(2)23(22-16)18-8-4-3-5-9-18)28(29)26-14-12-24-19-10-6-7-11-20(19)25-13-15-27-28/h3-11H,12-15H2,1-2H3