N-[[3-methyl-7-[(2S)-2-morpholin-4-ium-4-ylpropanoyl]-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methyl]thiophene-2-sulfonamide

Systemtic Name: N-[[3-methyl-7-[(2S)-2-morpholin-4-ium-4-ylpropanoyl]-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methyl]thiophene-2-sulfonamide Openeye Name: N-[[3-methyl-7-[(2S)-2-morpholin-4-ium-4-ylpropanoyl]-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methyl]thiophene-2-sulfonamide CAS Name: N-[[3-methyl-7-[(2S)-2-(4-morpholin-4-iumyl)-1-oxopropyl]-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methyl]-2-thiophenesulfonamide IUPAC Name: N-[[3-methyl-7-[(2S)-2-morpholin-4-ium-4-ylpropanoyl]-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methyl]thiophene-2-sulfonamide Traditional Name: N-[[3-methyl-7-[(2S)-2-morpholin-4-ium-4-ylpropanoyl]-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methyl]thiophene-2-sulfonamide Formula: C21H29N4O4S2+ MolecularWeight: 465.60936

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C2CN(CCC2=C1CNS(=O)(=O)C3=CC=CS3)C(=O)C(C)[NH+]4CCOCC4

Isomeric SMILES

CC1=NC=C2CN(CCC2=C1CNS(=O)(=O)C3=CC=CS3)C(=O)[C@H](C)[NH+]4CCOCC4

InChI

InChI=1S/C21H28N4O4S2/c1-15-19(13-23-31(27,28)20-4-3-11-30-20)18-5-6-25(14-17(18)12-22-15)21(26)16(2)24-7-9-29-10-8-24/h3-4,11-12,16,23H,5-10,13-14H2,1-2H3/p+1/t16-/m0/s1