N-[1-(4-cyanophenyl)-1-(isoquinolin-5-ylsulfamoyl)-2-methyl-3-oxidanylidene-1-phenyl-3-pyrrolidin-2-yl-propan-2-yl]propanamide

Systemtic Name: N-[1-(4-cyanophenyl)-1-(isoquinolin-5-ylsulfamoyl)-2-methyl-3-oxidanylidene-1-phenyl-3-pyrrolidin-2-yl-propan-2-yl]propanamide Openeye Name: N-[2-(4-cyanophenyl)-2-(5-isoquinolylsulfamoyl)-1-methyl-2-phenyl-1-(pyrrolidine-2-carbonyl)ethyl]propanamide CAS Name: N-[1-(4-cyanophenyl)-1-(5-isoquinolinylsulfamoyl)-2-methyl-3-oxo-1-phenyl-3-(2-pyrrolidinyl)propan-2-yl]propanamide IUPAC Name: N-[1-(4-cyanophenyl)-1-(isoquinolin-5-ylsulfamoyl)-2-methyl-3-oxo-1-phenyl-3-pyrrolidin-2-ylpropan-2-yl]propanamide Traditional Name: N-[2-(4-cyanophenyl)-2-(5-isoquinolylsulfamoyl)-1-methyl-2-phenyl-1-prolyl-ethyl]propionamide Formula: C33H33N5O4S MolecularWeight: 595.71122

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC(C)(C(=O)C1CCCN1)C(C2=CC=CC=C2)(C3=CC=C(C=C3)C#N)S(=O)(=O)NC4=CC=CC5=C4C=CN=C5

Isomeric SMILES

CCC(=O)NC(C)(C(=O)C1CCCN1)C(C2=CC=CC=C2)(C3=CC=C(C=C3)C#N)S(=O)(=O)NC4=CC=CC5=C4C=CN=C5

InChI

InChI=1S/C33H33N5O4S/c1-3-30(39)37-32(2,31(40)29-13-8-19-36-29)33(25-10-5-4-6-11-25,26-16-14-23(21-34)15-17-26)43(41,42)38-28-12-7-9-24-22-35-20-18-27(24)28/h4-7,9-12,14-18,20,22,29,36,38H,3,8,13,19H2,1-2H3,(H,37,39)