6-methylsulfonyl-2-(1H-1,2,4-triazol-5-ylsulfanyl)-1,3-benzothiazole

Systemtic Name: 6-methylsulfonyl-2-(1H-1,2,4-triazol-5-ylsulfanyl)-1,3-benzothiazole Openeye Name: 6-methylsulfonyl-2-(1H-1,2,4-triazol-5-ylsulfanyl)-1,3-benzothiazole CAS Name: 6-methylsulfonyl-2-(1H-1,2,4-triazol-5-ylthio)-1,3-benzothiazole IUPAC Name: 6-methylsulfonyl-2-(1H-1,2,4-triazol-5-ylsulfanyl)-1,3-benzothiazole Traditional Name: 6-mesyl-2-(1H-1,2,4-triazol-5-ylthio)-1,3-benzothiazole Formula: C10H8N4O2S3 MolecularWeight: 312.39112

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC2=C(C=C1)N=C(S2)SC3=NC=NN3

Isomeric SMILES

CS(=O)(=O)C1=CC2=C(C=C1)N=C(S2)SC3=NC=NN3

InChI

InChI=1S/C10H8N4O2S3/c1-19(15,16)6-2-3-7-8(4-6)17-10(13-7)18-9-11-5-12-14-9/h2-5H,1H3,(H,11,12,14)