O-[3,3-dimethyl-1-(4-methylphenoxy)butan-2-yl] imidazole-1-carbothioate

Systemtic Name: O-[3,3-dimethyl-1-(4-methylphenoxy)butan-2-yl] imidazole-1-carbothioate Openeye Name: O-[2,2-dimethyl-1-[(4-methylphenoxy)methyl]propyl] imidazole-1-carbothioate CAS Name: 1-imidazolecarbothioic acid O-[3,3-dimethyl-1-(4-methylphenoxy)butan-2-yl] ester IUPAC Name: O-[3,3-dimethyl-1-(4-methylphenoxy)butan-2-yl] imidazole-1-carbothioate Traditional Name: imidazole-1-carbothioic acid O-[2,2-dimethyl-1-[(4-methylphenoxy)methyl]propyl] ester Formula: C17H22N2O2S MolecularWeight: 318.43378

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H22N2O2S/c1-13-5-7-14(8-6-13)20-11-15(17(2,3)4)21-16(22)19-10-9-18-12-19/h5-10,12,15H,11H2,1-4H3