5-chloranyl-2-(2-methyl-4-nitro-phenyl)sulfanyl-1,3-benzothiazole

Systemtic Name: 5-chloranyl-2-(2-methyl-4-nitro-phenyl)sulfanyl-1,3-benzothiazole Openeye Name: 5-chloro-2-(2-methyl-4-nitro-phenyl)sulfanyl-1,3-benzothiazole CAS Name: 5-chloro-2-[(2-methyl-4-nitrophenyl)thio]-1,3-benzothiazole IUPAC Name: 5-chloro-2-(2-methyl-4-nitrophenyl)sulfanyl-1,3-benzothiazole Traditional Name: 5-chloro-2-[(2-methyl-4-nitro-phenyl)thio]-1,3-benzothiazole Formula: C14H9ClN2O2S2 MolecularWeight: 336.81646

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)[N+](=O)[O-])SC2=NC3=C(S2)C=CC(=C3)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)[N+](=O)[O-])SC2=NC3=C(S2)C=CC(=C3)Cl

InChI

InChI=1S/C14H9ClN2O2S2/c1-8-6-10(17(18)19)3-5-12(8)20-14-16-11-7-9(15)2-4-13(11)21-14/h2-7H,1H3