1-(3,4-dihydro-1H-isoquinolin-2-yl)-4-(2,5-dimethylthiophen-3-yl)butane-1,4-dione

Systemtic Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-4-(2,5-dimethylthiophen-3-yl)butane-1,4-dione Openeye Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-4-(2,5-dimethyl-3-thienyl)butane-1,4-dione CAS Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-4-(2,5-dimethyl-3-thiophenyl)butane-1,4-dione IUPAC Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-4-(2,5-dimethylthiophen-3-yl)butane-1,4-dione Traditional Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-4-(2,5-dimethyl-3-thienyl)butane-1,4-dione Formula: C19H21NO2S MolecularWeight: 327.44054

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)C)C(=O)CCC(=O)N2CCC3=CC=CC=C3C2

Isomeric SMILES

CC1=CC(=C(S1)C)C(=O)CCC(=O)N2CCC3=CC=CC=C3C2

InChI

InChI=1S/C19H21NO2S/c1-13-11-17(14(2)23-13)18(21)7-8-19(22)20-10-9-15-5-3-4-6-16(15)12-20/h3-6,11H,7-10,12H2,1-2H3