N-[(5-methylfuran-2-yl)methyl]-2-methylsulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: N-[(5-methylfuran-2-yl)methyl]-2-methylsulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: N-[(5-methyl-2-furyl)methyl]-2-methylsulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: N-[(5-methyl-2-furanyl)methyl]-2-methylsulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: N-[(5-methylfuran-2-yl)methyl]-2-methylsulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: 2-mesyl-N-[(5-methyl-2-furyl)methyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C17H20N2O4S MolecularWeight: 348.4167

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)CNC(=O)C2CC3=CC=CC=C3CN2S(=O)(=O)C

Isomeric SMILES

CC1=CC=C(O1)CNC(=O)C2CC3=CC=CC=C3CN2S(=O)(=O)C

InChI

InChI=1S/C17H20N2O4S/c1-12-7-8-15(23-12)10-18-17(20)16-9-13-5-3-4-6-14(13)11-19(16)24(2,21)22/h3-8,16H,9-11H2,1-2H3,(H,18,20)