5-bromanyl-N-(2,3-dihydroindol-1-ylcarbothioyl)-2-hexoxy-benzamide

Systemtic Name: 5-bromanyl-N-(2,3-dihydroindol-1-ylcarbothioyl)-2-hexoxy-benzamide Openeye Name: 5-bromo-2-hexoxy-N-(indoline-1-carbothioyl)benzamide CAS Name: 5-bromo-N-[2,3-dihydroindol-1-yl(sulfanylidene)methyl]-2-hexoxybenzamide IUPAC Name: 5-bromo-N-(2,3-dihydroindole-1-carbothioyl)-2-hexoxybenzamide Traditional Name: 5-bromo-2-hexoxy-N-(indoline-1-carbothioyl)benzamide Formula: C22H25BrN2O2S MolecularWeight: 461.4151

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C=C1)Br)C(=O)NC(=S)N2CCC3=CC=CC=C32

Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1)Br)C(=O)NC(=S)N2CCC3=CC=CC=C32

InChI

InChI=1S/C22H25BrN2O2S/c1-2-3-4-7-14-27-20-11-10-17(23)15-18(20)21(26)24-22(28)25-13-12-16-8-5-6-9-19(16)25/h5-6,8-11,15H,2-4,7,12-14H2,1H3,(H,24,26,28)