2-[2-[(4-chlorophenyl)methylsulfonyl]ethylsulfanyl]-1,3-benzothiazole

Systemtic Name: 2-[2-[(4-chlorophenyl)methylsulfonyl]ethylsulfanyl]-1,3-benzothiazole Openeye Name: 2-[2-[(4-chlorophenyl)methylsulfonyl]ethylsulfanyl]-1,3-benzothiazole CAS Name: 2-[2-[(4-chlorophenyl)methylsulfonyl]ethylthio]-1,3-benzothiazole IUPAC Name: 2-[2-[(4-chlorophenyl)methylsulfonyl]ethylsulfanyl]-1,3-benzothiazole Traditional Name: 2-[2-(4-chlorobenzyl)sulfonylethylthio]-1,3-benzothiazole Formula: C16H14ClNO2S3 MolecularWeight: 383.93586

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H14ClNO2S3/c17-13-7-5-12(6-8-13)11-23(19,20)10-9-21-16-18-14-3-1-2-4-15(14)22-16/h1-8H,9-11H2