N-[2-(2-methoxyethoxymethylsulfanyl)-1,3-benzothiazol-6-yl]-5-methylsulfonyl-thiophene-2-carboxamide

Systemtic Name: N-[2-(2-methoxyethoxymethylsulfanyl)-1,3-benzothiazol-6-yl]-5-methylsulfonyl-thiophene-2-carboxamide Openeye Name: N-[2-(2-methoxyethoxymethylsulfanyl)-1,3-benzothiazol-6-yl]-5-methylsulfonyl-thiophene-2-carboxamide CAS Name: N-[2-(2-methoxyethoxymethylthio)-1,3-benzothiazol-6-yl]-5-methylsulfonyl-2-thiophenecarboxamide IUPAC Name: N-[2-(2-methoxyethoxymethylsulfanyl)-1,3-benzothiazol-6-yl]-5-methylsulfonylthiophene-2-carboxamide Traditional Name: 5-mesyl-N-[2-(2-methoxyethoxymethylthio)-1,3-benzothiazol-6-yl]thiophene-2-carboxamide Formula: C17H18N2O5S4 MolecularWeight: 458.59522

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Descriptors Computed from Structure

Canonical SMILES:

COCCOCSC1=NC2=C(S1)C=C(C=C2)NC(=O)C3=CC=C(S3)S(=O)(=O)C

Isomeric SMILES

COCCOCSC1=NC2=C(S1)C=C(C=C2)NC(=O)C3=CC=C(S3)S(=O)(=O)C

InChI

InChI=1S/C17H18N2O5S4/c1-23-7-8-24-10-25-17-19-12-4-3-11(9-14(12)27-17)18-16(20)13-5-6-15(26-13)28(2,21)22/h3-6,9H,7-8,10H2,1-2H3,(H,18,20)