[4-(1,3-benzodioxol-5-ylmethyl)-1-methyl-5-phenylsulfanyl-imidazol-2-yl]imino-triphenyl-$l^{5}-phosphane

Systemtic Name: [4-(1,3-benzodioxol-5-ylmethyl)-1-methyl-5-phenylsulfanyl-imidazol-2-yl]imino-triphenyl-$l^{5}-phosphane Openeye Name: [4-(1,3-benzodioxol-5-ylmethyl)-1-methyl-5-phenylsulfanyl-imidazol-2-yl]imino-triphenyl-$l^{5}-phosphane CAS Name: [4-(1,3-benzodioxol-5-ylmethyl)-1-methyl-5-(phenylthio)-2-imidazolyl]imino-triphenylphosphorane IUPAC Name: [4-(1,3-benzodioxol-5-ylmethyl)-1-methyl-5-phenylsulfanylimidazol-2-yl]imino-triphenyl-$l^{5}-phosphane Traditional Name: [1-methyl-5-(phenylthio)-4-piperonyl-imidazol-2-yl]imino-triphenyl-phosphorane Formula: C36H30N3O2PS MolecularWeight: 599.681061

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(N=C1N=P(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)CC5=CC6=C(C=C5)OCO6)SC7=CC=CC=C7

Isomeric SMILES

CN1C(=C(N=C1N=P(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)CC5=CC6=C(C=C5)OCO6)SC7=CC=CC=C7

InChI

InChI=1S/C36H30N3O2PS/c1-39-35(43-31-20-12-5-13-21-31)32(24-27-22-23-33-34(25-27)41-26-40-33)37-36(39)38-42(28-14-6-2-7-15-28,29-16-8-3-9-17-29)30-18-10-4-11-19-30/h2-23,25H,24,26H2,1H3