decyl (1E)-N-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxycarbonyl-methyl-amino]sulfanyl-2-phenyl-ethanimidothioate

Systemtic Name: decyl (1E)-N-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxycarbonyl-methyl-amino]sulfanyl-2-phenyl-ethanimidothioate Openeye Name: decyl (1E)-N-[(2,2-dimethyl-3H-benzofuran-7-yl)oxycarbonyl-methyl-amino]sulfanyl-2-phenyl-ethanimidothioate CAS Name: (1E)-N-[[[(2,2-dimethyl-3H-benzofuran-7-yl)oxy-oxomethyl]-methylamino]thio]-2-phenylethanimidothioic acid decyl ester IUPAC Name: decyl (1E)-N-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxycarbonyl-methylamino]sulfanyl-2-phenylethanimidothioate Traditional Name: (1E)-N-[[(2,2-dimethylcoumaran-7-yl)oxycarbonyl-methyl-amino]thio]-2-phenyl-thioacetimidic acid decyl ester Formula: C30H42N2O3S2 MolecularWeight: 542.79608

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCSC(=NSN(C)C(=O)OC1=CC=CC2=C1OC(C2)(C)C)CC3=CC=CC=C3

Isomeric SMILES

CCCCCCCCCCS/C(=N/SN(C)C(=O)OC1=CC=CC2=C1OC(C2)(C)C)/CC3=CC=CC=C3

InChI

InChI=1S/C30H42N2O3S2/c1-5-6-7-8-9-10-11-15-21-36-27(22-24-17-13-12-14-18-24)31-37-32(4)29(33)34-26-20-16-19-25-23-30(2,3)35-28(25)26/h12-14,16-20H,5-11,15,21-23H2,1-4H3/b31-27+