N-(4-azanyl-3-oxidanyl-4-oxidanylidene-1-phenyl-butan-2-yl)-5-chloranyl-2-(naphthalen-2-ylsulfonylamino)pyrimidine-4-carboxamide

Systemtic Name: N-(4-azanyl-3-oxidanyl-4-oxidanylidene-1-phenyl-butan-2-yl)-5-chloranyl-2-(naphthalen-2-ylsulfonylamino)pyrimidine-4-carboxamide Openeye Name: N-(3-amino-1-benzyl-2-hydroxy-3-oxo-propyl)-5-chloro-2-(2-naphthylsulfonylamino)pyrimidine-4-carboxamide CAS Name: N-(4-amino-3-hydroxy-4-oxo-1-phenylbutan-2-yl)-5-chloro-2-(2-naphthalenylsulfonylamino)-4-pyrimidinecarboxamide IUPAC Name: N-(4-amino-3-hydroxy-4-oxo-1-phenylbutan-2-yl)-5-chloro-2-(naphthalen-2-ylsulfonylamino)pyrimidine-4-carboxamide Traditional Name: N-(3-amino-1-benzyl-2-hydroxy-3-keto-propyl)-5-chloro-2-(2-naphthylsulfonylamino)pyrimidine-4-carboxamide Formula: C25H22ClN5O5S MolecularWeight: 539.99068

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(C(=O)N)O)NC(=O)C2=NC(=NC=C2Cl)NS(=O)(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

C1=CC=C(C=C1)CC(C(C(=O)N)O)NC(=O)C2=NC(=NC=C2Cl)NS(=O)(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C25H22ClN5O5S/c26-19-14-28-25(31-37(35,36)18-11-10-16-8-4-5-9-17(16)13-18)30-21(19)24(34)29-20(22(32)23(27)33)12-15-6-2-1-3-7-15/h1-11,13-14,20,22,32H,12H2,(H2,27,33)(H,29,34)(H,28,30,31)