N-(1,3-benzothiazol-2-yl)-2-methyl-3,5-dinitro-benzamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-2-methyl-3,5-dinitro-benzamide Openeye Name: N-(1,3-benzothiazol-2-yl)-2-methyl-3,5-dinitro-benzamide CAS Name: N-(1,3-benzothiazol-2-yl)-2-methyl-3,5-dinitrobenzamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-2-methyl-3,5-dinitrobenzamide Traditional Name: N-(1,3-benzothiazol-2-yl)-2-methyl-3,5-dinitro-benzamide Formula: C15H10N4O5S MolecularWeight: 358.3287

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1C(=O)NC2=NC3=CC=CC=C3S2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1C(=O)NC2=NC3=CC=CC=C3S2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C15H10N4O5S/c1-8-10(6-9(18(21)22)7-12(8)19(23)24)14(20)17-15-16-11-4-2-3-5-13(11)25-15/h2-7H,1H3,(H,16,17,20)