[2-[2-(dodecanoylamino)-1,3-thiazol-4-yl]phenyl] dodecanoate

Systemtic Name: [2-[2-(dodecanoylamino)-1,3-thiazol-4-yl]phenyl] dodecanoate Openeye Name: [2-[2-(dodecanoylamino)thiazol-4-yl]phenyl] dodecanoate CAS Name: dodecanoic acid [2-[2-(1-oxododecylamino)-4-thiazolyl]phenyl] ester IUPAC Name: [2-[2-(dodecanoylamino)-1,3-thiazol-4-yl]phenyl] dodecanoate Traditional Name: lauric acid [2-[2-(lauroylamino)thiazol-4-yl]phenyl] ester Formula: C33H52N2O3S MolecularWeight: 556.84258

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)NC1=NC(=CS1)C2=CC=CC=C2OC(=O)CCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCC(=O)NC1=NC(=CS1)C2=CC=CC=C2OC(=O)CCCCCCCCCCC

InChI

InChI=1S/C33H52N2O3S/c1-3-5-7-9-11-13-15-17-19-25-31(36)35-33-34-29(27-39-33)28-23-21-22-24-30(28)38-32(37)26-20-18-16-14-12-10-8-6-4-2/h21-24,27H,3-20,25-26H2,1-2H3,(H,34,35,36)