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

Systemtic Name: [4-[4-(5-butyl-1,3,4-thiadiazol-2-yl)phenyl]phenyl] (E)-but-2-enoate Openeye Name: [4-[4-(5-butyl-1,3,4-thiadiazol-2-yl)phenyl]phenyl] (E)-but-2-enoate CAS Name: (E)-2-butenoic acid [4-[4-(5-butyl-1,3,4-thiadiazol-2-yl)phenyl]phenyl] ester IUPAC Name: [4-[4-(5-butyl-1,3,4-thiadiazol-2-yl)phenyl]phenyl] (E)-but-2-enoate Traditional Name: (E)-but-2-enoic acid [4-[4-(5-butyl-1,3,4-thiadiazol-2-yl)phenyl]phenyl] ester Formula: C22H22N2O2S MolecularWeight: 378.48728

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NN=C(S1)C2=CC=C(C=C2)C3=CC=C(C=C3)OC(=O)C=CC

Isomeric SMILES

CCCCC1=NN=C(S1)C2=CC=C(C=C2)C3=CC=C(C=C3)OC(=O)/C=C/C

InChI

InChI=1S/C22H22N2O2S/c1-3-5-7-20-23-24-22(27-20)18-10-8-16(9-11-18)17-12-14-19(15-13-17)26-21(25)6-4-2/h4,6,8-15H,3,5,7H2,1-2H3/b6-4+