O-[5-(4-methylphenyl)sulfinylpentan-2-yl] imidazole-1-carbothioate

Systemtic Name: O-[5-(4-methylphenyl)sulfinylpentan-2-yl] imidazole-1-carbothioate Openeye Name: O-[1-methyl-4-(p-tolylsulfinyl)butyl] imidazole-1-carbothioate CAS Name: 1-imidazolecarbothioic acid O-[5-(4-methylphenyl)sulfinylpentan-2-yl] ester IUPAC Name: O-[5-(4-methylphenyl)sulfinylpentan-2-yl] imidazole-1-carbothioate Traditional Name: imidazole-1-carbothioic acid O-[1-methyl-4-(p-tolylsulfinyl)butyl] ester Formula: C16H20N2O2S2 MolecularWeight: 336.4722

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)CCCC(C)OC(=S)N2C=CN=C2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)CCCC(C)OC(=S)N2C=CN=C2

InChI

InChI=1S/C16H20N2O2S2/c1-13-5-7-15(8-6-13)22(19)11-3-4-14(2)20-16(21)18-10-9-17-12-18/h5-10,12,14H,3-4,11H2,1-2H3