N-(4-methoxyphenyl)-4-[2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]ethanoylamino]benzamide

Systemtic Name: N-(4-methoxyphenyl)-4-[2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]ethanoylamino]benzamide Openeye Name: N-(4-methoxyphenyl)-4-[[2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]acetyl]amino]benzamide CAS Name: N-(4-methoxyphenyl)-4-[[2-[(6-nitro-1,3-benzothiazol-2-yl)thio]-1-oxoethyl]amino]benzamide IUPAC Name: N-(4-methoxyphenyl)-4-[[2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]acetyl]amino]benzamide Traditional Name: N-(4-methoxyphenyl)-4-[[2-[(6-nitro-1,3-benzothiazol-2-yl)thio]acetyl]amino]benzamide Formula: C23H18N4O5S2 MolecularWeight: 494.54282

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)NC(=O)CSC3=NC4=C(S3)C=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)NC(=O)CSC3=NC4=C(S3)C=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H18N4O5S2/c1-32-18-9-6-16(7-10-18)25-22(29)14-2-4-15(5-3-14)24-21(28)13-33-23-26-19-11-8-17(27(30)31)12-20(19)34-23/h2-12H,13H2,1H3,(H,24,28)(H,25,29)