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

Systemtic Name: O-[3,3-dimethyl-1-(4-propylphenoxy)butan-2-yl] imidazole-1-carbothioate Openeye Name: O-[2,2-dimethyl-1-[(4-propylphenoxy)methyl]propyl] imidazole-1-carbothioate CAS Name: 1-imidazolecarbothioic acid O-[3,3-dimethyl-1-(4-propylphenoxy)butan-2-yl] ester IUPAC Name: O-[3,3-dimethyl-1-(4-propylphenoxy)butan-2-yl] imidazole-1-carbothioate Traditional Name: imidazole-1-carbothioic acid O-[2,2-dimethyl-1-[(4-propylphenoxy)methyl]propyl] ester Formula: C19H26N2O2S MolecularWeight: 346.48694

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)OCC(C(C)(C)C)OC(=S)N2C=CN=C2

Isomeric SMILES

CCCC1=CC=C(C=C1)OCC(C(C)(C)C)OC(=S)N2C=CN=C2

InChI

InChI=1S/C19H26N2O2S/c1-5-6-15-7-9-16(10-8-15)22-13-17(19(2,3)4)23-18(24)21-12-11-20-14-21/h7-12,14,17H,5-6,13H2,1-4H3