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

Systemtic Name: 5-[[5-(3-methylbutoxymethyl)-2-oxidanylidene-oxolan-3-yl]methyl]-2-[(3-methylphenyl)amino]-1,3-thiazol-4-one Openeye Name: 5-[[5-(isopentyloxymethyl)-2-oxo-tetrahydrofuran-3-yl]methyl]-2-(3-methylanilino)thiazol-4-one CAS Name: 2-(3-methylanilino)-5-[[5-(3-methylbutoxymethyl)-2-oxo-3-oxolanyl]methyl]-4-thiazolone IUPAC Name: 2-(3-methylanilino)-5-[[5-(3-methylbutoxymethyl)-2-oxooxolan-3-yl]methyl]-1,3-thiazol-4-one Traditional Name: 5-[[5-(isoamoxymethyl)-2-keto-tetrahydrofuran-3-yl]methyl]-2-(m-toluidino)-2-thiazolin-4-one Formula: C21H28N2O4S MolecularWeight: 404.52302

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC2=NC(=O)C(S2)CC3CC(OC3=O)COCCC(C)C

Isomeric SMILES

CC1=CC(=CC=C1)NC2=NC(=O)C(S2)CC3CC(OC3=O)COCCC(C)C

InChI

InChI=1S/C21H28N2O4S/c1-13(2)7-8-26-12-17-10-15(20(25)27-17)11-18-19(24)23-21(28-18)22-16-6-4-5-14(3)9-16/h4-6,9,13,15,17-18H,7-8,10-12H2,1-3H3,(H,22,23,24)