5-[(5-chloranyl-1,3-benzothiazol-2-yl)sulfanylmethyl]-3-(phenylmethyl)-1,2,4-oxadiazole

Systemtic Name: 5-[(5-chloranyl-1,3-benzothiazol-2-yl)sulfanylmethyl]-3-(phenylmethyl)-1,2,4-oxadiazole Openeye Name: 3-benzyl-5-[(5-chloro-1,3-benzothiazol-2-yl)sulfanylmethyl]-1,2,4-oxadiazole CAS Name: 5-[[(5-chloro-1,3-benzothiazol-2-yl)thio]methyl]-3-(phenylmethyl)-1,2,4-oxadiazole IUPAC Name: 3-benzyl-5-[(5-chloro-1,3-benzothiazol-2-yl)sulfanylmethyl]-1,2,4-oxadiazole Traditional Name: 3-benzyl-5-[[(5-chloro-1,3-benzothiazol-2-yl)thio]methyl]-1,2,4-oxadiazole Formula: C17H12ClN3OS2 MolecularWeight: 373.87968

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=NOC(=N2)CSC3=NC4=C(S3)C=CC(=C4)Cl

Isomeric SMILES

C1=CC=C(C=C1)CC2=NOC(=N2)CSC3=NC4=C(S3)C=CC(=C4)Cl

InChI

InChI=1S/C17H12ClN3OS2/c18-12-6-7-14-13(9-12)19-17(24-14)23-10-16-20-15(21-22-16)8-11-4-2-1-3-5-11/h1-7,9H,8,10H2