S-[(6-bromanyl-1,3-benzodioxol-5-yl)methyl] 2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carbothioate

Systemtic Name: S-[(6-bromanyl-1,3-benzodioxol-5-yl)methyl] 2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carbothioate Openeye Name: S-[(6-bromo-1,3-benzodioxol-5-yl)methyl] 2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropanecarbothioate CAS Name: 2,2-dimethyl-3-(2-methylprop-1-enyl)-1-cyclopropanecarbothioic acid S-[(6-bromo-1,3-benzodioxol-5-yl)methyl] ester IUPAC Name: S-[(6-bromo-1,3-benzodioxol-5-yl)methyl] 2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carbothioate Traditional Name: 2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropanecarbothioic acid S-[(6-bromo-1,3-benzodioxol-5-yl)methyl] ester Formula: C18H21BrO3S MolecularWeight: 397.32654

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC1C(C1(C)C)C(=O)SCC2=CC3=C(C=C2Br)OCO3)C

Isomeric SMILES

CC(=CC1C(C1(C)C)C(=O)SCC2=CC3=C(C=C2Br)OCO3)C

InChI

InChI=1S/C18H21BrO3S/c1-10(2)5-12-16(18(12,3)4)17(20)23-8-11-6-14-15(7-13(11)19)22-9-21-14/h5-7,12,16H,8-9H2,1-4H3