5-bromanyl-N-(heptylcarbamothioyl)-2-propan-2-yloxy-benzamide

Systemtic Name: 5-bromanyl-N-(heptylcarbamothioyl)-2-propan-2-yloxy-benzamide Openeye Name: 5-bromo-N-(heptylcarbamothioyl)-2-isopropoxy-benzamide CAS Name: 5-bromo-N-[(heptylamino)-sulfanylidenemethyl]-2-propan-2-yloxybenzamide IUPAC Name: 5-bromo-N-(heptylcarbamothioyl)-2-propan-2-yloxybenzamide Traditional Name: 5-bromo-N-(heptylthiocarbamoyl)-2-isopropoxy-benzamide Formula: C18H27BrN2O2S MolecularWeight: 415.38818

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCNC(=S)NC(=O)C1=C(C=CC(=C1)Br)OC(C)C

Isomeric SMILES

CCCCCCCNC(=S)NC(=O)C1=C(C=CC(=C1)Br)OC(C)C

InChI

InChI=1S/C18H27BrN2O2S/c1-4-5-6-7-8-11-20-18(24)21-17(22)15-12-14(19)9-10-16(15)23-13(2)3/h9-10,12-13H,4-8,11H2,1-3H3,(H2,20,21,22,24)