3-[1-(2-methylpropyl)-3,6-dihydro-2H-pyridin-4-yl]-1-sulfanylidene-indol-1-ium

Systemtic Name: 3-[1-(2-methylpropyl)-3,6-dihydro-2H-pyridin-4-yl]-1-sulfanylidene-indol-1-ium Openeye Name: 3-(1-isobutyl-3,6-dihydro-2H-pyridin-4-yl)-1-thioxo-indol-1-ium CAS Name: 3-[1-(2-methylpropyl)-3,6-dihydro-2H-pyridin-4-yl]-1-sulfanylideneindol-1-ium IUPAC Name: 3-[1-(2-methylpropyl)-3,6-dihydro-2H-pyridin-4-yl]-1-sulfanylideneindol-1-ium Traditional Name: 3-(1-isobutyl-3,6-dihydro-2H-pyridin-4-yl)-1-thioxo-indol-1-ium Formula: C17H21N2S+ MolecularWeight: 285.42704

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1CCC(=CC1)C2=C[N+](=S)C3=CC=CC=C32

Isomeric SMILES

CC(C)CN1CCC(=CC1)C2=C[N+](=S)C3=CC=CC=C32

InChI

InChI=1S/C17H21N2S/c1-13(2)11-18-9-7-14(8-10-18)16-12-19(20)17-6-4-3-5-15(16)17/h3-7,12-13H,8-11H2,1-2H3/q+1