N-[2-(1,3-benzothiazol-2-yl)-5-nitro-phenyl]-2,2-dimethyl-propanamide

Systemtic Name: N-[2-(1,3-benzothiazol-2-yl)-5-nitro-phenyl]-2,2-dimethyl-propanamide Openeye Name: N-[2-(1,3-benzothiazol-2-yl)-5-nitro-phenyl]-2,2-dimethyl-propanamide CAS Name: N-[2-(1,3-benzothiazol-2-yl)-5-nitrophenyl]-2,2-dimethylpropanamide IUPAC Name: N-[2-(1,3-benzothiazol-2-yl)-5-nitrophenyl]-2,2-dimethylpropanamide Traditional Name: N-[2-(1,3-benzothiazol-2-yl)-5-nitro-phenyl]-2,2-dimethyl-propionamide Formula: C18H17N3O3S MolecularWeight: 355.41088

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NC1=C(C=CC(=C1)[N+](=O)[O-])C2=NC3=CC=CC=C3S2

Isomeric SMILES

CC(C)(C)C(=O)NC1=C(C=CC(=C1)[N+](=O)[O-])C2=NC3=CC=CC=C3S2

InChI

InChI=1S/C18H17N3O3S/c1-18(2,3)17(22)20-14-10-11(21(23)24)8-9-12(14)16-19-13-6-4-5-7-15(13)25-16/h4-10H,1-3H3,(H,20,22)