N-[6,8-bis(bromanyl)-4-oxidanylidene-3,1-benzothiazin-2-yl]-4-pentyl-benzamide

Systemtic Name: N-[6,8-bis(bromanyl)-4-oxidanylidene-3,1-benzothiazin-2-yl]-4-pentyl-benzamide Openeye Name: N-(6,8-dibromo-4-oxo-3,1-benzothiazin-2-yl)-4-pentyl-benzamide CAS Name: N-(6,8-dibromo-4-oxo-3,1-benzothiazin-2-yl)-4-pentylbenzamide IUPAC Name: N-(6,8-dibromo-4-oxo-3,1-benzothiazin-2-yl)-4-pentylbenzamide Traditional Name: 4-amyl-N-(6,8-dibromo-4-keto-3,1-benzothiazin-2-yl)benzamide Formula: C20H18Br2N2O2S MolecularWeight: 510.24212

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C(=O)NC2=NC3=C(C=C(C=C3C(=O)S2)Br)Br

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C(=O)NC2=NC3=C(C=C(C=C3C(=O)S2)Br)Br

InChI

InChI=1S/C20H18Br2N2O2S/c1-2-3-4-5-12-6-8-13(9-7-12)18(25)24-20-23-17-15(19(26)27-20)10-14(21)11-16(17)22/h6-11H,2-5H2,1H3,(H,23,24,25)