2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]-1-piperidin-1-yl-ethanone

Systemtic Name: 2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]-1-piperidin-1-yl-ethanone Openeye Name: 2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]-1-(1-piperidyl)ethanone CAS Name: 2-[(6-nitro-1,3-benzothiazol-2-yl)thio]-1-(1-piperidinyl)ethanone IUPAC Name: 2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]-1-piperidin-1-ylethanone Traditional Name: 2-[(6-nitro-1,3-benzothiazol-2-yl)thio]-1-piperidino-ethanone Formula: C14H15N3O3S2 MolecularWeight: 337.4172

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)CSC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)C(=O)CSC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C14H15N3O3S2/c18-13(16-6-2-1-3-7-16)9-21-14-15-11-5-4-10(17(19)20)8-12(11)22-14/h4-5,8H,1-3,6-7,9H2