[4-(5-butyl-1,3,4-thiadiazol-2-yl)phenyl] (E)-hex-2-enoate

Systemtic Name: [4-(5-butyl-1,3,4-thiadiazol-2-yl)phenyl] (E)-hex-2-enoate Openeye Name: [4-(5-butyl-1,3,4-thiadiazol-2-yl)phenyl] (E)-hex-2-enoate CAS Name: (E)-2-hexenoic acid [4-(5-butyl-1,3,4-thiadiazol-2-yl)phenyl] ester IUPAC Name: [4-(5-butyl-1,3,4-thiadiazol-2-yl)phenyl] (E)-hex-2-enoate Traditional Name: (E)-hex-2-enoic acid [4-(5-butyl-1,3,4-thiadiazol-2-yl)phenyl] ester Formula: C18H22N2O2S MolecularWeight: 330.44448

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NN=C(S1)C2=CC=C(C=C2)OC(=O)C=CCCC

Isomeric SMILES

CCCCC1=NN=C(S1)C2=CC=C(C=C2)OC(=O)/C=C/CCC

InChI

InChI=1S/C18H22N2O2S/c1-3-5-7-9-17(21)22-15-12-10-14(11-13-15)18-20-19-16(23-18)8-6-4-2/h7,9-13H,3-6,8H2,1-2H3/b9-7+