N-(2-ethylsulfonyl-3,4-dihydro-1H-isoquinolin-7-yl)-2,4,6-trimethyl-benzamide

Systemtic Name: N-(2-ethylsulfonyl-3,4-dihydro-1H-isoquinolin-7-yl)-2,4,6-trimethyl-benzamide Openeye Name: N-(2-ethylsulfonyl-3,4-dihydro-1H-isoquinolin-7-yl)-2,4,6-trimethyl-benzamide CAS Name: N-(2-ethylsulfonyl-3,4-dihydro-1H-isoquinolin-7-yl)-2,4,6-trimethylbenzamide IUPAC Name: N-(2-ethylsulfonyl-3,4-dihydro-1H-isoquinolin-7-yl)-2,4,6-trimethylbenzamide Traditional Name: N-(2-esyl-3,4-dihydro-1H-isoquinolin-7-yl)-2,4,6-trimethyl-benzamide Formula: C21H26N2O3S MolecularWeight: 386.50774

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CCC2=C(C1)C=C(C=C2)NC(=O)C3=C(C=C(C=C3C)C)C

Isomeric SMILES

CCS(=O)(=O)N1CCC2=C(C1)C=C(C=C2)NC(=O)C3=C(C=C(C=C3C)C)C

InChI

InChI=1S/C21H26N2O3S/c1-5-27(25,26)23-9-8-17-6-7-19(12-18(17)13-23)22-21(24)20-15(3)10-14(2)11-16(20)4/h6-7,10-12H,5,8-9,13H2,1-4H3,(H,22,24)