1-[4-[5-(4-pentoxyphenyl)-1,3,4-thiadiazol-2-yl]phenyl]ethanone

Systemtic Name: 1-[4-[5-(4-pentoxyphenyl)-1,3,4-thiadiazol-2-yl]phenyl]ethanone Openeye Name: 1-[4-[5-(4-pentoxyphenyl)-1,3,4-thiadiazol-2-yl]phenyl]ethanone CAS Name: 1-[4-[5-(4-pentoxyphenyl)-1,3,4-thiadiazol-2-yl]phenyl]ethanone IUPAC Name: 1-[4-[5-(4-pentoxyphenyl)-1,3,4-thiadiazol-2-yl]phenyl]ethanone Traditional Name: 1-[4-[5-(4-amoxyphenyl)-1,3,4-thiadiazol-2-yl]phenyl]ethanone Formula: C21H22N2O2S MolecularWeight: 366.47658

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)C2=NN=C(S2)C3=CC=C(C=C3)C(=O)C

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)C2=NN=C(S2)C3=CC=C(C=C3)C(=O)C

InChI

InChI=1S/C21H22N2O2S/c1-3-4-5-14-25-19-12-10-18(11-13-19)21-23-22-20(26-21)17-8-6-16(7-9-17)15(2)24/h6-13H,3-5,14H2,1-2H3