[3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenyl]-[(2S)-2-methylmorpholin-4-yl]methanone

Systemtic Name: [3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenyl]-[(2S)-2-methylmorpholin-4-yl]methanone Openeye Name: [3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenyl]-[(2S)-2-methylmorpholin-4-yl]methanone CAS Name: [3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenyl]-[(2S)-2-methyl-4-morpholinyl]methanone IUPAC Name: [3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenyl]-[(2S)-2-methylmorpholin-4-yl]methanone Traditional Name: [3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenyl]-[(2S)-2-methylmorpholino]methanone Formula: C21H24N2O4S MolecularWeight: 400.49126

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCO1)C(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCC4=CC=CC=C4C3

Isomeric SMILES

C[C@H]1CN(CCO1)C(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C21H24N2O4S/c1-16-14-22(11-12-27-16)21(24)18-7-4-8-20(13-18)28(25,26)23-10-9-17-5-2-3-6-19(17)15-23/h2-8,13,16H,9-12,14-15H2,1H3/t16-/m0/s1