2-[(5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]-1,3-benzothiazole

Systemtic Name: 2-[(5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]-1,3-benzothiazole Openeye Name: 2-[(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]-1,3-benzothiazole CAS Name: 2-[(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methylthio]-1,3-benzothiazole IUPAC Name: 2-[(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]-1,3-benzothiazole Traditional Name: 2-[(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methylthio]-1,3-benzothiazole Formula: C16H12ClNO2S2 MolecularWeight: 349.85498

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=C(C=C2Cl)CSC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1COC2=C(O1)C=C(C=C2Cl)CSC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C16H12ClNO2S2/c17-11-7-10(8-13-15(11)20-6-5-19-13)9-21-16-18-12-3-1-2-4-14(12)22-16/h1-4,7-8H,5-6,9H2