N-[3-[(6-methoxy-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]propyl]-4-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[3-[(6-methoxy-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]propyl]-4-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-[3-[(6-methoxy-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]propyl]-4-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-[3-[(6-methoxy-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]propyl]-4-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-[3-[(6-methoxy-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]propyl]-4-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-[3-[(6-methoxy-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]propyl]-4-pyrrolidinosulfonyl-benzamide Formula: C24H31N3O6S2 MolecularWeight: 521.64944

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(CN(CC2)S(=O)(=O)CCCNC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCC4)C=C1

Isomeric SMILES

COC1=CC2=C(CN(CC2)S(=O)(=O)CCCNC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCC4)C=C1

InChI

InChI=1S/C24H31N3O6S2/c1-33-22-8-5-21-18-27(15-11-20(21)17-22)34(29,30)16-4-12-25-24(28)19-6-9-23(10-7-19)35(31,32)26-13-2-3-14-26/h5-10,17H,2-4,11-16,18H2,1H3,(H,25,28)