N-(3-ethynylphenyl)-3-oxidanylidene-4H-1,4-benzothiazine-6-carboxamide

Systemtic Name: N-(3-ethynylphenyl)-3-oxidanylidene-4H-1,4-benzothiazine-6-carboxamide Openeye Name: N-(3-ethynylphenyl)-3-oxo-4H-1,4-benzothiazine-6-carboxamide CAS Name: N-(3-ethynylphenyl)-3-oxo-4H-1,4-benzothiazine-6-carboxamide IUPAC Name: N-(3-ethynylphenyl)-3-oxo-4H-1,4-benzothiazine-6-carboxamide Traditional Name: N-(3-ethynylphenyl)-3-keto-4H-1,4-benzothiazine-6-carboxamide Formula: C17H12N2O2S MolecularWeight: 308.35438

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1=CC(=CC=C1)NC(=O)C2=CC3=C(C=C2)SCC(=O)N3

Isomeric SMILES

C#CC1=CC(=CC=C1)NC(=O)C2=CC3=C(C=C2)SCC(=O)N3

InChI

InChI=1S/C17H12N2O2S/c1-2-11-4-3-5-13(8-11)18-17(21)12-6-7-15-14(9-12)19-16(20)10-22-15/h1,3-9H,10H2,(H,18,21)(H,19,20)