2-[(4-nitro-1,3-benzothiazol-5-yl)amino]-N-propan-2-yl-ethanamide

Systemtic Name: 2-[(4-nitro-1,3-benzothiazol-5-yl)amino]-N-propan-2-yl-ethanamide Openeye Name: N-isopropyl-2-[(4-nitro-1,3-benzothiazol-5-yl)amino]acetamide CAS Name: 2-[(4-nitro-1,3-benzothiazol-5-yl)amino]-N-propan-2-ylacetamide IUPAC Name: 2-[(4-nitro-1,3-benzothiazol-5-yl)amino]-N-propan-2-ylacetamide Traditional Name: N-isopropyl-2-[(4-nitro-1,3-benzothiazol-5-yl)amino]acetamide Formula: C12H14N4O3S MolecularWeight: 294.32956

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)CNC1=C(C2=C(C=C1)SC=N2)[N+](=O)[O-]

Isomeric SMILES

CC(C)NC(=O)CNC1=C(C2=C(C=C1)SC=N2)[N+](=O)[O-]

InChI

InChI=1S/C12H14N4O3S/c1-7(2)15-10(17)5-13-8-3-4-9-11(14-6-20-9)12(8)16(18)19/h3-4,6-7,13H,5H2,1-2H3,(H,15,17)