3,4-dihydro-1H-isoquinolin-2-yl-[5-(3,5-dimethylpiperidin-1-yl)sulfonyl-3-methyl-1-benzofuran-2-yl]methanone

Systemtic Name: 3,4-dihydro-1H-isoquinolin-2-yl-[5-(3,5-dimethylpiperidin-1-yl)sulfonyl-3-methyl-1-benzofuran-2-yl]methanone Openeye Name: 3,4-dihydro-1H-isoquinolin-2-yl-[5-[(3,5-dimethyl-1-piperidyl)sulfonyl]-3-methyl-benzofuran-2-yl]methanone CAS Name: 3,4-dihydro-1H-isoquinolin-2-yl-[5-[(3,5-dimethyl-1-piperidinyl)sulfonyl]-3-methyl-2-benzofuranyl]methanone IUPAC Name: 3,4-dihydro-1H-isoquinolin-2-yl-[5-(3,5-dimethylpiperidin-1-yl)sulfonyl-3-methyl-1-benzofuran-2-yl]methanone Traditional Name: 3,4-dihydro-1H-isoquinolin-2-yl-[5-(3,5-dimethylpiperidino)sulfonyl-3-methyl-benzofuran-2-yl]methanone Formula: C26H30N2O4S MolecularWeight: 466.5924

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)S(=O)(=O)C2=CC3=C(C=C2)OC(=C3C)C(=O)N4CCC5=CC=CC=C5C4)C

Isomeric SMILES

CC1CC(CN(C1)S(=O)(=O)C2=CC3=C(C=C2)OC(=C3C)C(=O)N4CCC5=CC=CC=C5C4)C

InChI

InChI=1S/C26H30N2O4S/c1-17-12-18(2)15-28(14-17)33(30,31)22-8-9-24-23(13-22)19(3)25(32-24)26(29)27-11-10-20-6-4-5-7-21(20)16-27/h4-9,13,17-18H,10-12,14-16H2,1-3H3