6-methylsulfonyl-2-[(3-propan-2-yl-1,2,4-triazol-1-yl)sulfanyl]-1,3-benzothiazole

Systemtic Name: 6-methylsulfonyl-2-[(3-propan-2-yl-1,2,4-triazol-1-yl)sulfanyl]-1,3-benzothiazole Openeye Name: 2-[(3-isopropyl-1,2,4-triazol-1-yl)sulfanyl]-6-methylsulfonyl-1,3-benzothiazole CAS Name: 6-methylsulfonyl-2-[(3-propan-2-yl-1,2,4-triazol-1-yl)thio]-1,3-benzothiazole IUPAC Name: 6-methylsulfonyl-2-[(3-propan-2-yl-1,2,4-triazol-1-yl)sulfanyl]-1,3-benzothiazole Traditional Name: 2-[(3-isopropyl-1,2,4-triazol-1-yl)thio]-6-mesyl-1,3-benzothiazole Formula: C13H14N4O2S3 MolecularWeight: 354.47086

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NN(C=N1)SC2=NC3=C(S2)C=C(C=C3)S(=O)(=O)C

Isomeric SMILES

CC(C)C1=NN(C=N1)SC2=NC3=C(S2)C=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C13H14N4O2S3/c1-8(2)12-14-7-17(16-12)21-13-15-10-5-4-9(22(3,18)19)6-11(10)20-13/h4-8H,1-3H3