N-[[4-(4-methylpiperazin-4-ium-1-yl)phenyl]methyl]-5-(1,2-oxazol-5-yl)thiophene-2-sulfonamide

Systemtic Name: N-[[4-(4-methylpiperazin-4-ium-1-yl)phenyl]methyl]-5-(1,2-oxazol-5-yl)thiophene-2-sulfonamide Openeye Name: 5-isoxazol-5-yl-N-[[4-(4-methylpiperazin-4-ium-1-yl)phenyl]methyl]thiophene-2-sulfonamide CAS Name: 5-(5-isoxazolyl)-N-[[4-(4-methyl-1-piperazin-4-iumyl)phenyl]methyl]-2-thiophenesulfonamide IUPAC Name: N-[[4-(4-methylpiperazin-4-ium-1-yl)phenyl]methyl]-5-(1,2-oxazol-5-yl)thiophene-2-sulfonamide Traditional Name: 5-isoxazol-5-yl-N-[4-(4-methylpiperazin-4-ium-1-yl)benzyl]thiophene-2-sulfonamide Formula: C19H23N4O3S2+ MolecularWeight: 419.54092

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=CC=C(C=C2)CNS(=O)(=O)C3=CC=C(S3)C4=CC=NO4

Isomeric SMILES

C[NH+]1CCN(CC1)C2=CC=C(C=C2)CNS(=O)(=O)C3=CC=C(S3)C4=CC=NO4

InChI

InChI=1S/C19H22N4O3S2/c1-22-10-12-23(13-11-22)16-4-2-15(3-5-16)14-21-28(24,25)19-7-6-18(27-19)17-8-9-20-26-17/h2-9,21H,10-14H2,1H3/p+1