3-[4-(butylaminomethyl)phenyl]sulfonylthiophene-2-sulfonamide

Systemtic Name: 3-[4-(butylaminomethyl)phenyl]sulfonylthiophene-2-sulfonamide Openeye Name: 3-[4-(butylaminomethyl)phenyl]sulfonylthiophene-2-sulfonamide CAS Name: 3-[4-(butylaminomethyl)phenyl]sulfonyl-2-thiophenesulfonamide IUPAC Name: 3-[4-(butylaminomethyl)phenyl]sulfonylthiophene-2-sulfonamide Traditional Name: 3-[4-(butylaminomethyl)phenyl]sulfonylthiophene-2-sulfonamide Formula: C15H20N2O4S3 MolecularWeight: 388.5253

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNCC1=CC=C(C=C1)S(=O)(=O)C2=C(SC=C2)S(=O)(=O)N

Isomeric SMILES

CCCCNCC1=CC=C(C=C1)S(=O)(=O)C2=C(SC=C2)S(=O)(=O)N

InChI

InChI=1S/C15H20N2O4S3/c1-2-3-9-17-11-12-4-6-13(7-5-12)23(18,19)14-8-10-22-15(14)24(16,20)21/h4-8,10,17H,2-3,9,11H2,1H3,(H2,16,20,21)