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

Systemtic Name: 2-[(2-chloranyl-4-nitro-phenyl)methyl]-5-methyl-1,3-benzothiazole Openeye Name: 2-[(2-chloro-4-nitro-phenyl)methyl]-5-methyl-1,3-benzothiazole CAS Name: 2-[(2-chloro-4-nitrophenyl)methyl]-5-methyl-1,3-benzothiazole IUPAC Name: 2-[(2-chloro-4-nitrophenyl)methyl]-5-methyl-1,3-benzothiazole Traditional Name: 2-(2-chloro-4-nitro-benzyl)-5-methyl-1,3-benzothiazole Formula: C15H11ClN2O2S MolecularWeight: 318.77804

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)SC(=N2)CC3=C(C=C(C=C3)[N+](=O)[O-])Cl

Isomeric SMILES

CC1=CC2=C(C=C1)SC(=N2)CC3=C(C=C(C=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C15H11ClN2O2S/c1-9-2-5-14-13(6-9)17-15(21-14)7-10-3-4-11(18(19)20)8-12(10)16/h2-6,8H,7H2,1H3