4-[2-methyl-1,1-bis(oxidanylidene)-1$l^{6},2-benzothiazin-3-yl]butanenitrile

Systemtic Name: 4-[2-methyl-1,1-bis(oxidanylidene)-1$l^{6},2-benzothiazin-3-yl]butanenitrile Openeye Name: 4-(2-methyl-1,1-dioxo-1$l^{6},2-benzothiazin-3-yl)butanenitrile CAS Name: 4-(2-methyl-1,1-dioxo-1$l^{6},2-benzothiazin-3-yl)butanenitrile IUPAC Name: 4-(2-methyl-1,1-dioxo-1$l^{6},2-benzothiazin-3-yl)butanenitrile Traditional Name: 4-(1,1-diketo-2-methyl-1$l^{6},2-benzothiazin-3-yl)butyronitrile Formula: C13H14N2O2S MolecularWeight: 262.32746

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC2=CC=CC=C2S1(=O)=O)CCCC#N

Isomeric SMILES

CN1C(=CC2=CC=CC=C2S1(=O)=O)CCCC#N

InChI

InChI=1S/C13H14N2O2S/c1-15-12(7-4-5-9-14)10-11-6-2-3-8-13(11)18(15,16)17/h2-3,6,8,10H,4-5,7H2,1H3