(3R)-N-[2-(1,3-benzothiazol-2-ylsulfanyl)ethanoyl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide

Systemtic Name: (3R)-N-[2-(1,3-benzothiazol-2-ylsulfanyl)ethanoyl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide Openeye Name: (3R)-N-[2-(1,3-benzothiazol-2-ylsulfanyl)acetyl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide CAS Name: (3R)-N-[2-(1,3-benzothiazol-2-ylthio)-1-oxoethyl]-2,3-dihydro-1,4-benzodioxin-3-carboxamide IUPAC Name: (3R)-N-[2-(1,3-benzothiazol-2-ylsulfanyl)acetyl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide Traditional Name: (3R)-N-[2-(1,3-benzothiazol-2-ylthio)acetyl]-2,3-dihydro-1,4-benzodioxin-3-carboxamide Formula: C18H14N2O4S2 MolecularWeight: 386.44476

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=CC=CC=C2O1)C(=O)NC(=O)CSC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1[C@@H](OC2=CC=CC=C2O1)C(=O)NC(=O)CSC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C18H14N2O4S2/c21-16(10-25-18-19-11-5-1-4-8-15(11)26-18)20-17(22)14-9-23-12-6-2-3-7-13(12)24-14/h1-8,14H,9-10H2,(H,20,21,22)/t14-/m1/s1