methyl 4-(5-nonyl-1,3,4-thiadiazol-2-yl)benzoate

Systemtic Name: methyl 4-(5-nonyl-1,3,4-thiadiazol-2-yl)benzoate Openeye Name: methyl 4-(5-nonyl-1,3,4-thiadiazol-2-yl)benzoate CAS Name: 4-(5-nonyl-1,3,4-thiadiazol-2-yl)benzoic acid methyl ester IUPAC Name: methyl 4-(5-nonyl-1,3,4-thiadiazol-2-yl)benzoate Traditional Name: 4-(5-nonyl-1,3,4-thiadiazol-2-yl)benzoic acid methyl ester Formula: C19H26N2O2S MolecularWeight: 346.48694

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=NN=C(S1)C2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

CCCCCCCCCC1=NN=C(S1)C2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C19H26N2O2S/c1-3-4-5-6-7-8-9-10-17-20-21-18(24-17)15-11-13-16(14-12-15)19(22)23-2/h11-14H,3-10H2,1-2H3