2-[(3-chlorophenyl)methylsulfonyl]-1,3-benzothiazole

Systemtic Name: 2-[(3-chlorophenyl)methylsulfonyl]-1,3-benzothiazole Openeye Name: 2-[(3-chlorophenyl)methylsulfonyl]-1,3-benzothiazole CAS Name: 2-[(3-chlorophenyl)methylsulfonyl]-1,3-benzothiazole IUPAC Name: 2-[(3-chlorophenyl)methylsulfonyl]-1,3-benzothiazole Traditional Name: 2-(3-chlorobenzyl)sulfonyl-1,3-benzothiazole Formula: C14H10ClNO2S2 MolecularWeight: 323.8177

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)S(=O)(=O)CC3=CC(=CC=C3)Cl

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)S(=O)(=O)CC3=CC(=CC=C3)Cl

InChI

InChI=1S/C14H10ClNO2S2/c15-11-5-3-4-10(8-11)9-20(17,18)14-16-12-6-1-2-7-13(12)19-14/h1-8H,9H2