4-[2-[(1-methyl-6-oxidanylidene-4-pyridin-4-yl-pyrimidin-2-yl)amino]ethyl]benzenesulfonamide

Systemtic Name: 4-[2-[(1-methyl-6-oxidanylidene-4-pyridin-4-yl-pyrimidin-2-yl)amino]ethyl]benzenesulfonamide Openeye Name: 4-[2-[[1-methyl-6-oxo-4-(4-pyridyl)pyrimidin-2-yl]amino]ethyl]benzenesulfonamide CAS Name: 4-[2-[(1-methyl-6-oxo-4-pyridin-4-yl-2-pyrimidinyl)amino]ethyl]benzenesulfonamide IUPAC Name: 4-[2-[(1-methyl-6-oxo-4-pyridin-4-ylpyrimidin-2-yl)amino]ethyl]benzenesulfonamide Traditional Name: 4-[2-[[6-keto-1-methyl-4-(4-pyridyl)pyrimidin-2-yl]amino]ethyl]benzenesulfonamide Formula: C18H19N5O3S MolecularWeight: 385.44016

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C=C(N=C1NCCC2=CC=C(C=C2)S(=O)(=O)N)C3=CC=NC=C3

Isomeric SMILES

CN1C(=O)C=C(N=C1NCCC2=CC=C(C=C2)S(=O)(=O)N)C3=CC=NC=C3

InChI

InChI=1S/C18H19N5O3S/c1-23-17(24)12-16(14-7-9-20-10-8-14)22-18(23)21-11-6-13-2-4-15(5-3-13)27(19,25)26/h2-5,7-10,12H,6,11H2,1H3,(H,21,22)(H2,19,25,26)