2-(5-bromanylthiophen-2-yl)sulfonyl-1-(1-methylpyrrolidin-2-yl)-3,4-dihydro-1H-isoquinoline

Systemtic Name: 2-(5-bromanylthiophen-2-yl)sulfonyl-1-(1-methylpyrrolidin-2-yl)-3,4-dihydro-1H-isoquinoline Openeye Name: 2-[(5-bromo-2-thienyl)sulfonyl]-1-(1-methylpyrrolidin-2-yl)-3,4-dihydro-1H-isoquinoline CAS Name: 2-[(5-bromo-2-thiophenyl)sulfonyl]-1-(1-methyl-2-pyrrolidinyl)-3,4-dihydro-1H-isoquinoline IUPAC Name: 2-(5-bromothiophen-2-yl)sulfonyl-1-(1-methylpyrrolidin-2-yl)-3,4-dihydro-1H-isoquinoline Traditional Name: 2-[(5-bromo-2-thienyl)sulfonyl]-1-(1-methylpyrrolidin-2-yl)-3,4-dihydro-1H-isoquinoline Formula: C18H21BrN2O2S2 MolecularWeight: 441.40554

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCC1C2C3=CC=CC=C3CCN2S(=O)(=O)C4=CC=C(S4)Br

Isomeric SMILES

CN1CCCC1C2C3=CC=CC=C3CCN2S(=O)(=O)C4=CC=C(S4)Br

InChI

InChI=1S/C18H21BrN2O2S2/c1-20-11-4-7-15(20)18-14-6-3-2-5-13(14)10-12-21(18)25(22,23)17-9-8-16(19)24-17/h2-3,5-6,8-9,15,18H,4,7,10-12H2,1H3