2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-1-(2,5-dimethyl-1-propan-2-yl-pyrrol-3-yl)ethanone

Systemtic Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-1-(2,5-dimethyl-1-propan-2-yl-pyrrol-3-yl)ethanone Openeye Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-1-(1-isopropyl-2,5-dimethyl-pyrrol-3-yl)ethanone CAS Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)-1-(2,5-dimethyl-1-propan-2-yl-3-pyrrolyl)ethanone IUPAC Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-1-(2,5-dimethyl-1-propan-2-ylpyrrol-3-yl)ethanone Traditional Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)-1-(1-isopropyl-2,5-dimethyl-pyrrol-3-yl)ethanone Formula: C19H23NO3S MolecularWeight: 345.45582

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C(C)C)C)C(=O)CSC2=CC3=C(C=C2)OCCO3

Isomeric SMILES

CC1=CC(=C(N1C(C)C)C)C(=O)CSC2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C19H23NO3S/c1-12(2)20-13(3)9-16(14(20)4)17(21)11-24-15-5-6-18-19(10-15)23-8-7-22-18/h5-6,9-10,12H,7-8,11H2,1-4H3