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

Systemtic Name: 2-tert-butyl-6-nitro-5-piperidin-1-yl-1,3-benzothiazole Openeye Name: 2-tert-butyl-6-nitro-5-(1-piperidyl)-1,3-benzothiazole CAS Name: 2-tert-butyl-6-nitro-5-(1-piperidinyl)-1,3-benzothiazole IUPAC Name: 2-tert-butyl-6-nitro-5-piperidin-1-yl-1,3-benzothiazole Traditional Name: 2-tert-butyl-6-nitro-5-piperidino-1,3-benzothiazole Formula: C16H21N3O2S MolecularWeight: 319.42184

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NC2=CC(=C(C=C2S1)[N+](=O)[O-])N3CCCCC3

Isomeric SMILES

CC(C)(C)C1=NC2=CC(=C(C=C2S1)[N+](=O)[O-])N3CCCCC3

InChI

InChI=1S/C16H21N3O2S/c1-16(2,3)15-17-11-9-12(18-7-5-4-6-8-18)13(19(20)21)10-14(11)22-15/h9-10H,4-8H2,1-3H3