[6-(5-hexyl-1,3,4-thiadiazol-2-yl)naphthalen-2-yl] heptanoate

Systemtic Name: [6-(5-hexyl-1,3,4-thiadiazol-2-yl)naphthalen-2-yl] heptanoate Openeye Name: [6-(5-hexyl-1,3,4-thiadiazol-2-yl)-2-naphthyl] heptanoate CAS Name: heptanoic acid [6-(5-hexyl-1,3,4-thiadiazol-2-yl)-2-naphthalenyl] ester IUPAC Name: [6-(5-hexyl-1,3,4-thiadiazol-2-yl)naphthalen-2-yl] heptanoate Traditional Name: enanthic acid [6-(5-hexyl-1,3,4-thiadiazol-2-yl)-2-naphthyl] ester Formula: C25H32N2O2S MolecularWeight: 424.59878

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=NN=C(S1)C2=CC3=C(C=C2)C=C(C=C3)OC(=O)CCCCCC

Isomeric SMILES

CCCCCCC1=NN=C(S1)C2=CC3=C(C=C2)C=C(C=C3)OC(=O)CCCCCC

InChI

InChI=1S/C25H32N2O2S/c1-3-5-7-9-11-23-26-27-25(30-23)21-14-13-20-18-22(16-15-19(20)17-21)29-24(28)12-10-8-6-4-2/h13-18H,3-12H2,1-2H3