2-(5-bromanylthiophen-2-yl)sulfonyl-6,7-diethoxy-1-methyl-3,4-dihydro-1H-isoquinoline

Systemtic Name: 2-(5-bromanylthiophen-2-yl)sulfonyl-6,7-diethoxy-1-methyl-3,4-dihydro-1H-isoquinoline Openeye Name: 2-[(5-bromo-2-thienyl)sulfonyl]-6,7-diethoxy-1-methyl-3,4-dihydro-1H-isoquinoline CAS Name: 2-[(5-bromo-2-thiophenyl)sulfonyl]-6,7-diethoxy-1-methyl-3,4-dihydro-1H-isoquinoline IUPAC Name: 2-(5-bromothiophen-2-yl)sulfonyl-6,7-diethoxy-1-methyl-3,4-dihydro-1H-isoquinoline Traditional Name: 2-[(5-bromo-2-thienyl)sulfonyl]-6,7-diethoxy-1-methyl-3,4-dihydro-1H-isoquinoline Formula: C18H22BrNO4S2 MolecularWeight: 460.40558

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(N(CCC2=C1)S(=O)(=O)C3=CC=C(S3)Br)C)OCC

Isomeric SMILES

CCOC1=C(C=C2C(N(CCC2=C1)S(=O)(=O)C3=CC=C(S3)Br)C)OCC

InChI

InChI=1S/C18H22BrNO4S2/c1-4-23-15-10-13-8-9-20(12(3)14(13)11-16(15)24-5-2)26(21,22)18-7-6-17(19)25-18/h6-7,10-12H,4-5,8-9H2,1-3H3