6-chloranyl-1,1-bis(oxidanylidene)-N-(pyridin-3-ylmethyl)-4H-1$l^{6},2,4-benzothiadiazin-3-amine

Systemtic Name: 6-chloranyl-1,1-bis(oxidanylidene)-N-(pyridin-3-ylmethyl)-4H-1$l^{6},2,4-benzothiadiazin-3-amine Openeye Name: 6-chloro-1,1-dioxo-N-(3-pyridylmethyl)-4H-1$l^{6},2,4-benzothiadiazin-3-amine CAS Name: 6-chloro-1,1-dioxo-N-(3-pyridinylmethyl)-4H-1$l^{6},2,4-benzothiadiazin-3-amine IUPAC Name: 6-chloro-1,1-dioxo-N-(pyridin-3-ylmethyl)-4H-1$l^{6},2,4-benzothiadiazin-3-amine Traditional Name: (6-chloro-1,1-diketo-4H-1$l^{6},2,4-benzothiadiazin-3-yl)-(3-pyridylmethyl)amine Formula: C13H11ClN4O2S MolecularWeight: 322.77004

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CNC2=NS(=O)(=O)C3=C(N2)C=C(C=C3)Cl

Isomeric SMILES

C1=CC(=CN=C1)CNC2=NS(=O)(=O)C3=C(N2)C=C(C=C3)Cl

InChI

InChI=1S/C13H11ClN4O2S/c14-10-3-4-12-11(6-10)17-13(18-21(12,19)20)16-8-9-2-1-5-15-7-9/h1-7H,8H2,(H2,16,17,18)