1-(2-methyl-2,3-dihydroindol-1-yl)-2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-propan-1-one

Systemtic Name: 1-(2-methyl-2,3-dihydroindol-1-yl)-2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-propan-1-one Openeye Name: 1-(2-methylindolin-1-yl)-2-(1-oxidopyridin-1-ium-2-yl)sulfanyl-propan-1-one CAS Name: 1-(2-methyl-2,3-dihydroindol-1-yl)-2-[(1-oxido-2-pyridin-1-iumyl)thio]-1-propanone IUPAC Name: 1-(2-methyl-2,3-dihydroindol-1-yl)-2-(1-oxidopyridin-1-ium-2-yl)sulfanylpropan-1-one Traditional Name: 1-(2-methylindolin-1-yl)-2-[(1-oxidopyridin-1-ium-2-yl)thio]propan-1-one Formula: C17H18N2O2S MolecularWeight: 314.40202

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=CC=CC=C2N1C(=O)C(C)SC3=CC=CC=[N+]3[O-]

Isomeric SMILES

CC1CC2=CC=CC=C2N1C(=O)C(C)SC3=CC=CC=[N+]3[O-]

InChI

InChI=1S/C17H18N2O2S/c1-12-11-14-7-3-4-8-15(14)19(12)17(20)13(2)22-16-9-5-6-10-18(16)21/h3-10,12-13H,11H2,1-2H3