N-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-4-(3-methylphenoxy)butanamide

Systemtic Name: N-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-4-(3-methylphenoxy)butanamide Openeye Name: N-[4-(1,3-benzodioxol-5-yl)thiazol-2-yl]-4-(3-methylphenoxy)butanamide CAS Name: N-[4-(1,3-benzodioxol-5-yl)-2-thiazolyl]-4-(3-methylphenoxy)butanamide IUPAC Name: N-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-4-(3-methylphenoxy)butanamide Traditional Name: N-[4-(1,3-benzodioxol-5-yl)thiazol-2-yl]-4-(3-methylphenoxy)butyramide Formula: C21H20N2O4S MolecularWeight: 396.4595

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCCC(=O)NC2=NC(=CS2)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=CC(=CC=C1)OCCCC(=O)NC2=NC(=CS2)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C21H20N2O4S/c1-14-4-2-5-16(10-14)25-9-3-6-20(24)23-21-22-17(12-28-21)15-7-8-18-19(11-15)27-13-26-18/h2,4-5,7-8,10-12H,3,6,9,13H2,1H3,(H,22,23,24)