1,1-bis(oxidanylidene)-N-[(2-sulfanylphenyl)methyl]-4H-1$l^{6},4-benzothiazine-2-carboxamide

Systemtic Name: 1,1-bis(oxidanylidene)-N-[(2-sulfanylphenyl)methyl]-4H-1$l^{6},4-benzothiazine-2-carboxamide Openeye Name: 1,1-dioxo-N-[(2-sulfanylphenyl)methyl]-4H-1$l^{6},4-benzothiazine-2-carboxamide CAS Name: N-[(2-mercaptophenyl)methyl]-1,1-dioxo-4H-1$l^{6},4-benzothiazine-2-carboxamide IUPAC Name: 1,1-dioxo-N-[(2-sulfanylphenyl)methyl]-4H-1$l^{6},4-benzothiazine-2-carboxamide Traditional Name: 1,1-diketo-N-(2-mercaptobenzyl)-4H-1$l^{6},4-benzothiazine-2-carboxamide Formula: C16H14N2O3S2 MolecularWeight: 346.42396

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CNC(=O)C2=CNC3=CC=CC=C3S2(=O)=O)S

Isomeric SMILES

C1=CC=C(C(=C1)CNC(=O)C2=CNC3=CC=CC=C3S2(=O)=O)S

InChI

InChI=1S/C16H14N2O3S2/c19-16(18-9-11-5-1-3-7-13(11)22)15-10-17-12-6-2-4-8-14(12)23(15,20)21/h1-8,10,17,22H,9H2,(H,18,19)