N-(2,3-dihydroindol-1-ylcarbothioyl)-4-heptoxy-benzamide

Systemtic Name: N-(2,3-dihydroindol-1-ylcarbothioyl)-4-heptoxy-benzamide Openeye Name: 4-heptoxy-N-(indoline-1-carbothioyl)benzamide CAS Name: N-[2,3-dihydroindol-1-yl(sulfanylidene)methyl]-4-heptoxybenzamide IUPAC Name: N-(2,3-dihydroindole-1-carbothioyl)-4-heptoxybenzamide Traditional Name: 4-heptoxy-N-(indoline-1-carbothioyl)benzamide Formula: C23H28N2O2S MolecularWeight: 396.54562

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)C(=O)NC(=S)N2CCC3=CC=CC=C32

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)C(=O)NC(=S)N2CCC3=CC=CC=C32

InChI

InChI=1S/C23H28N2O2S/c1-2-3-4-5-8-17-27-20-13-11-19(12-14-20)22(26)24-23(28)25-16-15-18-9-6-7-10-21(18)25/h6-7,9-14H,2-5,8,15-17H2,1H3,(H,24,26,28)