2-[2,6-bis(chloranyl)-4-nitro-phenyl]sulfanyl-1,3-benzothiazole-5-carbonitrile

Systemtic Name: 2-[2,6-bis(chloranyl)-4-nitro-phenyl]sulfanyl-1,3-benzothiazole-5-carbonitrile Openeye Name: 2-(2,6-dichloro-4-nitro-phenyl)sulfanyl-1,3-benzothiazole-5-carbonitrile CAS Name: 2-[(2,6-dichloro-4-nitrophenyl)thio]-1,3-benzothiazole-5-carbonitrile IUPAC Name: 2-(2,6-dichloro-4-nitrophenyl)sulfanyl-1,3-benzothiazole-5-carbonitrile Traditional Name: 2-[(2,6-dichloro-4-nitro-phenyl)thio]-1,3-benzothiazole-5-carbonitrile Formula: C14H5Cl2N3O2S2 MolecularWeight: 382.2444

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1C#N)N=C(S2)SC3=C(C=C(C=C3Cl)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC2=C(C=C1C#N)N=C(S2)SC3=C(C=C(C=C3Cl)[N+](=O)[O-])Cl

InChI

InChI=1S/C14H5Cl2N3O2S2/c15-9-4-8(19(20)21)5-10(16)13(9)23-14-18-11-3-7(6-17)1-2-12(11)22-14/h1-5H