4-[2-[[4-[1,1-bis(oxidanylidene)-1,4-thiazinan-4-yl]phenyl]amino]pyrimidin-4-yl]-N-(cyanomethyl)benzamide

Systemtic Name: 4-[2-[[4-[1,1-bis(oxidanylidene)-1,4-thiazinan-4-yl]phenyl]amino]pyrimidin-4-yl]-N-(cyanomethyl)benzamide Openeye Name: N-(cyanomethyl)-4-[2-[4-(1,1-dioxo-1,4-thiazinan-4-yl)anilino]pyrimidin-4-yl]benzamide CAS Name: N-(cyanomethyl)-4-[2-[4-(1,1-dioxo-1,4-thiazinan-4-yl)anilino]-4-pyrimidinyl]benzamide IUPAC Name: N-(cyanomethyl)-4-[2-[4-(1,1-dioxo-1,4-thiazinan-4-yl)anilino]pyrimidin-4-yl]benzamide Traditional Name: N-(cyanomethyl)-4-[2-[4-(1,1-diketo-1,4-thiazinan-4-yl)anilino]pyrimidin-4-yl]benzamide Formula: C23H22N6O3S MolecularWeight: 462.52418

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Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)(=O)CCN1C2=CC=C(C=C2)NC3=NC=CC(=N3)C4=CC=C(C=C4)C(=O)NCC#N

Isomeric SMILES

C1CS(=O)(=O)CCN1C2=CC=C(C=C2)NC3=NC=CC(=N3)C4=CC=C(C=C4)C(=O)NCC#N

InChI

InChI=1S/C23H22N6O3S/c24-10-12-25-22(30)18-3-1-17(2-4-18)21-9-11-26-23(28-21)27-19-5-7-20(8-6-19)29-13-15-33(31,32)16-14-29/h1-9,11H,12-16H2,(H,25,30)(H,26,27,28)