N-(4-methyl-1,3-benzothiazol-2-yl)-3-nitro-benzamide

Systemtic Name: N-(4-methyl-1,3-benzothiazol-2-yl)-3-nitro-benzamide Openeye Name: N-(4-methyl-1,3-benzothiazol-2-yl)-3-nitro-benzamide CAS Name: N-(4-methyl-1,3-benzothiazol-2-yl)-3-nitrobenzamide IUPAC Name: N-(4-methyl-1,3-benzothiazol-2-yl)-3-nitrobenzamide Traditional Name: N-(4-methyl-1,3-benzothiazol-2-yl)-3-nitro-benzamide Formula: C15H11N3O3S MolecularWeight: 313.33114

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)SC(=N2)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C2C(=CC=C1)SC(=N2)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C15H11N3O3S/c1-9-4-2-7-12-13(9)16-15(22-12)17-14(19)10-5-3-6-11(8-10)18(20)21/h2-8H,1H3,(H,16,17,19)