methyl 4-[bis(2-methylpropyl)carbamothioyloxy]-3,5-bis(bromanyl)benzoate

Systemtic Name: methyl 4-[bis(2-methylpropyl)carbamothioyloxy]-3,5-bis(bromanyl)benzoate Openeye Name: methyl 3,5-dibromo-4-(diisobutylcarbamothioyloxy)benzoate CAS Name: 4-[[bis(2-methylpropyl)amino]-sulfanylidenemethoxy]-3,5-dibromobenzoic acid methyl ester IUPAC Name: methyl 4-[bis(2-methylpropyl)carbamothioyloxy]-3,5-dibromobenzoate Traditional Name: 3,5-dibromo-4-(diisobutylthiocarbamoyloxy)benzoic acid methyl ester Formula: C17H23Br2NO3S MolecularWeight: 481.24242

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC(C)C)C(=S)OC1=C(C=C(C=C1Br)C(=O)OC)Br

Isomeric SMILES

CC(C)CN(CC(C)C)C(=S)OC1=C(C=C(C=C1Br)C(=O)OC)Br

InChI

InChI=1S/C17H23Br2NO3S/c1-10(2)8-20(9-11(3)4)17(24)23-15-13(18)6-12(7-14(15)19)16(21)22-5/h6-7,10-11H,8-9H2,1-5H3