2-(4-methoxyphenyl)sulfonyl-5-(phenylmethyl)sulfonyl-1,3,4-thiadiazole

Systemtic Name: 2-(4-methoxyphenyl)sulfonyl-5-(phenylmethyl)sulfonyl-1,3,4-thiadiazole Openeye Name: 2-benzylsulfonyl-5-(4-methoxyphenyl)sulfonyl-1,3,4-thiadiazole CAS Name: 2-(4-methoxyphenyl)sulfonyl-5-(phenylmethyl)sulfonyl-1,3,4-thiadiazole IUPAC Name: 2-benzylsulfonyl-5-(4-methoxyphenyl)sulfonyl-1,3,4-thiadiazole Traditional Name: 2-benzylsulfonyl-5-(4-methoxyphenyl)sulfonyl-1,3,4-thiadiazole Formula: C16H14N2O5S3 MolecularWeight: 410.48776

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)C2=NN=C(S2)S(=O)(=O)CC3=CC=CC=C3

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)C2=NN=C(S2)S(=O)(=O)CC3=CC=CC=C3

InChI

InChI=1S/C16H14N2O5S3/c1-23-13-7-9-14(10-8-13)26(21,22)16-18-17-15(24-16)25(19,20)11-12-5-3-2-4-6-12/h2-10H,11H2,1H3