3,4-dihydro-1H-isoquinolin-2-yl-(2-methyl-5-morpholin-4-ylsulfonyl-phenyl)methanone

Systemtic Name: 3,4-dihydro-1H-isoquinolin-2-yl-(2-methyl-5-morpholin-4-ylsulfonyl-phenyl)methanone Openeye Name: 3,4-dihydro-1H-isoquinolin-2-yl-(2-methyl-5-morpholinosulfonyl-phenyl)methanone CAS Name: 3,4-dihydro-1H-isoquinolin-2-yl-[2-methyl-5-(4-morpholinylsulfonyl)phenyl]methanone IUPAC Name: 3,4-dihydro-1H-isoquinolin-2-yl-(2-methyl-5-morpholin-4-ylsulfonylphenyl)methanone Traditional Name: 3,4-dihydro-1H-isoquinolin-2-yl-(2-methyl-5-morpholinosulfonyl-phenyl)methanone Formula: C21H24N2O4S MolecularWeight: 400.49126

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)C(=O)N3CCC4=CC=CC=C4C3

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)C(=O)N3CCC4=CC=CC=C4C3

InChI

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