(2R)-2-(2,4-dinitrophenyl)sulfanyl-2,4-dihydro-1,3-benzothiazole

Systemtic Name: (2R)-2-(2,4-dinitrophenyl)sulfanyl-2,4-dihydro-1,3-benzothiazole Openeye Name: (2R)-2-(2,4-dinitrophenyl)sulfanyl-2,4-dihydro-1,3-benzothiazole CAS Name: (2R)-2-[(2,4-dinitrophenyl)thio]-2,4-dihydro-1,3-benzothiazole IUPAC Name: (2R)-2-(2,4-dinitrophenyl)sulfanyl-2,4-dihydro-1,3-benzothiazole Traditional Name: (2R)-2-[(2,4-dinitrophenyl)thio]-2,4-dihydro-1,3-benzothiazole Formula: C13H9N3O4S2 MolecularWeight: 335.35826

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CC=C2C1=NC(S2)SC3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1C=CC=C2C1=N[C@@H](S2)SC3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C13H9N3O4S2/c17-15(18)8-5-6-12(10(7-8)16(19)20)22-13-14-9-3-1-2-4-11(9)21-13/h1-2,4-7,13H,3H2/t13-/m0/s1