N-[2-(3-methylbutanoylamino)-4-(4-methylphenyl)-1,3-thiazol-5-yl]furan-2-carboxamide

Systemtic Name: N-[2-(3-methylbutanoylamino)-4-(4-methylphenyl)-1,3-thiazol-5-yl]furan-2-carboxamide Openeye Name: N-[2-(3-methylbutanoylamino)-4-(p-tolyl)thiazol-5-yl]furan-2-carboxamide CAS Name: N-[2-[(3-methyl-1-oxobutyl)amino]-4-(4-methylphenyl)-5-thiazolyl]-2-furancarboxamide IUPAC Name: N-[2-(3-methylbutanoylamino)-4-(4-methylphenyl)-1,3-thiazol-5-yl]furan-2-carboxamide Traditional Name: N-[2-(isovalerylamino)-4-(p-tolyl)thiazol-5-yl]-2-furamide Formula: C20H21N3O3S MolecularWeight: 383.46404

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(SC(=N2)NC(=O)CC(C)C)NC(=O)C3=CC=CO3

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(SC(=N2)NC(=O)CC(C)C)NC(=O)C3=CC=CO3

InChI

InChI=1S/C20H21N3O3S/c1-12(2)11-16(24)21-20-22-17(14-8-6-13(3)7-9-14)19(27-20)23-18(25)15-5-4-10-26-15/h4-10,12H,11H2,1-3H3,(H,23,25)(H,21,22,24)