2-tert-butyl-6-nitro-5-pyrrolidin-1-yl-1,3-benzothiazole

Systemtic Name: 2-tert-butyl-6-nitro-5-pyrrolidin-1-yl-1,3-benzothiazole Openeye Name: 2-tert-butyl-6-nitro-5-pyrrolidin-1-yl-1,3-benzothiazole CAS Name: 2-tert-butyl-6-nitro-5-(1-pyrrolidinyl)-1,3-benzothiazole IUPAC Name: 2-tert-butyl-6-nitro-5-pyrrolidin-1-yl-1,3-benzothiazole Traditional Name: 2-tert-butyl-6-nitro-5-pyrrolidino-1,3-benzothiazole Formula: C15H19N3O2S MolecularWeight: 305.39526

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NC2=CC(=C(C=C2S1)[N+](=O)[O-])N3CCCC3

Isomeric SMILES

CC(C)(C)C1=NC2=CC(=C(C=C2S1)[N+](=O)[O-])N3CCCC3

InChI

InChI=1S/C15H19N3O2S/c1-15(2,3)14-16-10-8-11(17-6-4-5-7-17)12(18(19)20)9-13(10)21-14/h8-9H,4-7H2,1-3H3