6-chloranyl-3-[(4-nitrophenyl)methyl]-1,3-benzothiazol-2-imine

Systemtic Name: 6-chloranyl-3-[(4-nitrophenyl)methyl]-1,3-benzothiazol-2-imine Openeye Name: 6-chloro-3-[(4-nitrophenyl)methyl]-1,3-benzothiazol-2-imine CAS Name: 6-chloro-3-[(4-nitrophenyl)methyl]-1,3-benzothiazol-2-imine IUPAC Name: 6-chloro-3-[(4-nitrophenyl)methyl]-1,3-benzothiazol-2-imine Traditional Name: [6-chloro-3-(4-nitrobenzyl)-1,3-benzothiazol-2-ylidene]amine Formula: C14H10ClN3O2S MolecularWeight: 319.7661

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CN2C3=C(C=C(C=C3)Cl)SC2=N)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1CN2C3=C(C=C(C=C3)Cl)SC2=N)[N+](=O)[O-]

InChI

InChI=1S/C14H10ClN3O2S/c15-10-3-6-12-13(7-10)21-14(16)17(12)8-9-1-4-11(5-2-9)18(19)20/h1-7,16H,8H2