4-[1-azanyl-2-[2-(methylsulfonylamino)ethylamino]-2-oxidanylidene-ethyl]-N-pyridin-4-yl-benzamide

Systemtic Name: 4-[1-azanyl-2-[2-(methylsulfonylamino)ethylamino]-2-oxidanylidene-ethyl]-N-pyridin-4-yl-benzamide Openeye Name: 4-[1-amino-2-[2-(methanesulfonamido)ethylamino]-2-oxo-ethyl]-N-(4-pyridyl)benzamide CAS Name: 4-[1-amino-2-[2-(methanesulfonamido)ethylamino]-2-oxoethyl]-N-pyridin-4-ylbenzamide IUPAC Name: 4-[1-amino-2-[2-(methanesulfonamido)ethylamino]-2-oxoethyl]-N-pyridin-4-ylbenzamide Traditional Name: 4-[1-amino-2-keto-2-[2-(methanesulfonamido)ethylamino]ethyl]-N-(4-pyridyl)benzamide Formula: C17H21N5O4S MolecularWeight: 391.44474

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NCCNC(=O)C(C1=CC=C(C=C1)C(=O)NC2=CC=NC=C2)N

Isomeric SMILES

CS(=O)(=O)NCCNC(=O)C(C1=CC=C(C=C1)C(=O)NC2=CC=NC=C2)N

InChI

InChI=1S/C17H21N5O4S/c1-27(25,26)21-11-10-20-17(24)15(18)12-2-4-13(5-3-12)16(23)22-14-6-8-19-9-7-14/h2-9,15,21H,10-11,18H2,1H3,(H,20,24)(H,19,22,23)