(2S)-2-(1,3-benzodioxol-5-yloxy)-N-(5-bromanyl-1,3-thiazol-2-yl)butanamide

Systemtic Name: (2S)-2-(1,3-benzodioxol-5-yloxy)-N-(5-bromanyl-1,3-thiazol-2-yl)butanamide Openeye Name: (2S)-2-(1,3-benzodioxol-5-yloxy)-N-(5-bromothiazol-2-yl)butanamide CAS Name: (2S)-2-(1,3-benzodioxol-5-yloxy)-N-(5-bromo-2-thiazolyl)butanamide IUPAC Name: (2S)-2-(1,3-benzodioxol-5-yloxy)-N-(5-bromo-1,3-thiazol-2-yl)butanamide Traditional Name: (2S)-2-(1,3-benzodioxol-5-yloxy)-N-(5-bromothiazol-2-yl)butyramide Formula: C14H13BrN2O4S MolecularWeight: 385.23302

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=NC=C(S1)Br)OC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC[C@@H](C(=O)NC1=NC=C(S1)Br)OC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C14H13BrN2O4S/c1-2-9(13(18)17-14-16-6-12(15)22-14)21-8-3-4-10-11(5-8)20-7-19-10/h3-6,9H,2,7H2,1H3,(H,16,17,18)/t9-/m0/s1