2-methyl-N-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]furan-3-carboxamide

Systemtic Name: 2-methyl-N-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]furan-3-carboxamide Openeye Name: 2-methyl-N-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]furan-3-carboxamide CAS Name: 2-methyl-N-[4-[(4-methyl-1-piperazin-4-iumyl)sulfonyl]phenyl]-3-furancarboxamide IUPAC Name: 2-methyl-N-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]furan-3-carboxamide Traditional Name: 2-methyl-N-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]-3-furamide Formula: C17H22N3O4S+ MolecularWeight: 364.43928

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CO1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CC[NH+](CC3)C

Isomeric SMILES

CC1=C(C=CO1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CC[NH+](CC3)C

InChI

InChI=1S/C17H21N3O4S/c1-13-16(7-12-24-13)17(21)18-14-3-5-15(6-4-14)25(22,23)20-10-8-19(2)9-11-20/h3-7,12H,8-11H2,1-2H3,(H,18,21)/p+1