[1,2-bis(propylsulfonyl)pyrrolo[2,1-a]isoquinolin-3-yl]-(4-chlorophenyl)methanone

Systemtic Name: [1,2-bis(propylsulfonyl)pyrrolo[2,1-a]isoquinolin-3-yl]-(4-chlorophenyl)methanone Openeye Name: [1,2-bis(propylsulfonyl)pyrrolo[2,1-a]isoquinolin-3-yl]-(4-chlorophenyl)methanone CAS Name: [1,2-bis(propylsulfonyl)-3-pyrrolo[2,1-a]isoquinolinyl]-(4-chlorophenyl)methanone IUPAC Name: [1,2-bis(propylsulfonyl)pyrrolo[2,1-a]isoquinolin-3-yl]-(4-chlorophenyl)methanone Traditional Name: [1,2-bis(propylsulfonyl)pyrrol[2,1-a]isoquinolin-3-yl]-(4-chlorophenyl)methanone Formula: C25H24ClNO5S2 MolecularWeight: 518.04476

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)C1=C2C3=CC=CC=C3C=CN2C(=C1S(=O)(=O)CCC)C(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

CCCS(=O)(=O)C1=C2C3=CC=CC=C3C=CN2C(=C1S(=O)(=O)CCC)C(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C25H24ClNO5S2/c1-3-15-33(29,30)24-21-20-8-6-5-7-17(20)13-14-27(21)22(25(24)34(31,32)16-4-2)23(28)18-9-11-19(26)12-10-18/h5-14H,3-4,15-16H2,1-2H3