5-methyl-2-[5-[(5-methylsulfonyl-1,3-thiazol-2-yl)sulfanyl]-1,2,3,4-tetrazol-1-yl]benzenethiol

Systemtic Name: 5-methyl-2-[5-[(5-methylsulfonyl-1,3-thiazol-2-yl)sulfanyl]-1,2,3,4-tetrazol-1-yl]benzenethiol Openeye Name: 5-methyl-2-[5-(5-methylsulfonylthiazol-2-yl)sulfanyltetrazol-1-yl]benzenethiol CAS Name: 5-methyl-2-[5-[(5-methylsulfonyl-2-thiazolyl)thio]-1-tetrazolyl]benzenethiol IUPAC Name: 5-methyl-2-[5-[(5-methylsulfonyl-1,3-thiazol-2-yl)sulfanyl]tetrazol-1-yl]benzenethiol Traditional Name: 2-[5-[(5-mesylthiazol-2-yl)thio]tetrazol-1-yl]-5-methyl-benzenethiol Formula: C12H11N5O2S4 MolecularWeight: 385.50804

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2C(=NN=N2)SC3=NC=C(S3)S(=O)(=O)C)S

Isomeric SMILES

CC1=CC(=C(C=C1)N2C(=NN=N2)SC3=NC=C(S3)S(=O)(=O)C)S

InChI

InChI=1S/C12H11N5O2S4/c1-7-3-4-8(9(20)5-7)17-11(14-15-16-17)22-12-13-6-10(21-12)23(2,18)19/h3-6,20H,1-2H3