3-hexyl-5-methyl-5-[2-[(4-methylphenyl)amino]-1,3-thiazol-4-yl]oxolan-2-one

Systemtic Name: 3-hexyl-5-methyl-5-[2-[(4-methylphenyl)amino]-1,3-thiazol-4-yl]oxolan-2-one Openeye Name: 3-hexyl-5-methyl-5-[2-(4-methylanilino)thiazol-4-yl]tetrahydrofuran-2-one CAS Name: 3-hexyl-5-methyl-5-[2-(4-methylanilino)-4-thiazolyl]-2-oxolanone IUPAC Name: 3-hexyl-5-methyl-5-[2-(4-methylanilino)-1,3-thiazol-4-yl]oxolan-2-one Traditional Name: 3-hexyl-5-methyl-5-[2-(p-toluidino)thiazol-4-yl]tetrahydrofuran-2-one Formula: C21H28N2O2S MolecularWeight: 372.52422

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1CC(OC1=O)(C)C2=CSC(=N2)NC3=CC=C(C=C3)C

Isomeric SMILES

CCCCCCC1CC(OC1=O)(C)C2=CSC(=N2)NC3=CC=C(C=C3)C

InChI

InChI=1S/C21H28N2O2S/c1-4-5-6-7-8-16-13-21(3,25-19(16)24)18-14-26-20(23-18)22-17-11-9-15(2)10-12-17/h9-12,14,16H,4-8,13H2,1-3H3,(H,22,23)