3-[(2-methyl-6-nitro-1,3-benzothiazol-5-yl)amino]propanamide

Systemtic Name: 3-[(2-methyl-6-nitro-1,3-benzothiazol-5-yl)amino]propanamide Openeye Name: 3-[(2-methyl-6-nitro-1,3-benzothiazol-5-yl)amino]propanamide CAS Name: 3-[(2-methyl-6-nitro-1,3-benzothiazol-5-yl)amino]propanamide IUPAC Name: 3-[(2-methyl-6-nitro-1,3-benzothiazol-5-yl)amino]propanamide Traditional Name: 3-[(2-methyl-6-nitro-1,3-benzothiazol-5-yl)amino]propionamide Formula: C11H12N4O3S MolecularWeight: 280.30298

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC(=C(C=C2S1)[N+](=O)[O-])NCCC(=O)N

Isomeric SMILES

CC1=NC2=CC(=C(C=C2S1)[N+](=O)[O-])NCCC(=O)N

InChI

InChI=1S/C11H12N4O3S/c1-6-14-8-4-7(13-3-2-11(12)16)9(15(17)18)5-10(8)19-6/h4-5,13H,2-3H2,1H3,(H2,12,16)