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

Systemtic Name: 4-methyl-3-nitro-N-[2-(propanoylamino)-1,3-benzothiazol-6-yl]benzamide Openeye Name: 4-methyl-3-nitro-N-[2-(propanoylamino)-1,3-benzothiazol-6-yl]benzamide CAS Name: 4-methyl-3-nitro-N-[2-(1-oxopropylamino)-1,3-benzothiazol-6-yl]benzamide IUPAC Name: 4-methyl-3-nitro-N-[2-(propanoylamino)-1,3-benzothiazol-6-yl]benzamide Traditional Name: 4-methyl-3-nitro-N-(2-propionamido-1,3-benzothiazol-6-yl)benzamide Formula: C18H16N4O4S MolecularWeight: 384.40904

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=NC2=C(S1)C=C(C=C2)NC(=O)C3=CC(=C(C=C3)C)[N+](=O)[O-]

Isomeric SMILES

CCC(=O)NC1=NC2=C(S1)C=C(C=C2)NC(=O)C3=CC(=C(C=C3)C)[N+](=O)[O-]

InChI

InChI=1S/C18H16N4O4S/c1-3-16(23)21-18-20-13-7-6-12(9-15(13)27-18)19-17(24)11-5-4-10(2)14(8-11)22(25)26/h4-9H,3H2,1-2H3,(H,19,24)(H,20,21,23)