4-[4-[(pyridin-2-ylmethylamino)methyl]phenyl]sulfonylthiophene-2-sulfonamide

Systemtic Name: 4-[4-[(pyridin-2-ylmethylamino)methyl]phenyl]sulfonylthiophene-2-sulfonamide Openeye Name: 4-[4-[(2-pyridylmethylamino)methyl]phenyl]sulfonylthiophene-2-sulfonamide CAS Name: 4-[4-[(2-pyridinylmethylamino)methyl]phenyl]sulfonyl-2-thiophenesulfonamide IUPAC Name: 4-[4-[(pyridin-2-ylmethylamino)methyl]phenyl]sulfonylthiophene-2-sulfonamide Traditional Name: 4-[4-[(2-pyridylmethylamino)methyl]phenyl]sulfonylthiophene-2-sulfonamide Formula: C17H17N3O4S3 MolecularWeight: 423.52958

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)CNCC2=CC=C(C=C2)S(=O)(=O)C3=CSC(=C3)S(=O)(=O)N

Isomeric SMILES

C1=CC=NC(=C1)CNCC2=CC=C(C=C2)S(=O)(=O)C3=CSC(=C3)S(=O)(=O)N

InChI

InChI=1S/C17H17N3O4S3/c18-27(23,24)17-9-16(12-25-17)26(21,22)15-6-4-13(5-7-15)10-19-11-14-3-1-2-8-20-14/h1-9,12,19H,10-11H2,(H2,18,23,24)