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

Systemtic Name: N-methyl-3-[2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]ethanoylamino]benzamide Openeye Name: N-methyl-3-[[2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]acetyl]amino]benzamide CAS Name: N-methyl-3-[[2-[(6-nitro-1,3-benzothiazol-2-yl)thio]-1-oxoethyl]amino]benzamide IUPAC Name: N-methyl-3-[[2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]acetyl]amino]benzamide Traditional Name: N-methyl-3-[[2-[(6-nitro-1,3-benzothiazol-2-yl)thio]acetyl]amino]benzamide Formula: C17H14N4O4S2 MolecularWeight: 402.44746

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CC(=CC=C1)NC(=O)CSC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CNC(=O)C1=CC(=CC=C1)NC(=O)CSC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H14N4O4S2/c1-18-16(23)10-3-2-4-11(7-10)19-15(22)9-26-17-20-13-6-5-12(21(24)25)8-14(13)27-17/h2-8H,9H2,1H3,(H,18,23)(H,19,22)