2-[[2-(2,4-dichlorophenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-3-yl]methoxy]-N-methyl-N-[1-(phenylmethyl)pyrrolidin-3-yl]ethanamide

Systemtic Name: 2-[[2-(2,4-dichlorophenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-3-yl]methoxy]-N-methyl-N-[1-(phenylmethyl)pyrrolidin-3-yl]ethanamide Openeye Name: N-(1-benzylpyrrolidin-3-yl)-2-[[2-(2,4-dichlorophenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-3-yl]methoxy]-N-methyl-acetamide CAS Name: 2-[[2-(2,4-dichlorophenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-3-yl]methoxy]-N-methyl-N-[1-(phenylmethyl)-3-pyrrolidinyl]acetamide IUPAC Name: N-(1-benzylpyrrolidin-3-yl)-2-[[2-(2,4-dichlorophenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-3-yl]methoxy]-N-methylacetamide Traditional Name: N-(1-benzylpyrrolidin-3-yl)-2-[[2-(2,4-dichlorophenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-3-yl]methoxy]-N-methyl-acetamide Formula: C30H33Cl2N3O4S MolecularWeight: 602.57172

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCN(C1)CC2=CC=CC=C2)C(=O)COCC3CC4=CC=CC=C4CN3S(=O)(=O)C5=C(C=C(C=C5)Cl)Cl

Isomeric SMILES

CN(C1CCN(C1)CC2=CC=CC=C2)C(=O)COCC3CC4=CC=CC=C4CN3S(=O)(=O)C5=C(C=C(C=C5)Cl)Cl

InChI

InChI=1S/C30H33Cl2N3O4S/c1-33(26-13-14-34(19-26)17-22-7-3-2-4-8-22)30(36)21-39-20-27-15-23-9-5-6-10-24(23)18-35(27)40(37,38)29-12-11-25(31)16-28(29)32/h2-12,16,26-27H,13-15,17-21H2,1H3