4-[(4-methyl-6-morpholin-4-yl-1,3,5-triazin-2-yl)amino]benzenesulfonic acid

Systemtic Name: 4-[(4-methyl-6-morpholin-4-yl-1,3,5-triazin-2-yl)amino]benzenesulfonic acid Openeye Name: 4-[(4-methyl-6-morpholino-1,3,5-triazin-2-yl)amino]benzenesulfonic acid CAS Name: 4-[[4-methyl-6-(4-morpholinyl)-1,3,5-triazin-2-yl]amino]benzenesulfonic acid IUPAC Name: 4-[(4-methyl-6-morpholin-4-yl-1,3,5-triazin-2-yl)amino]benzenesulfonic acid Traditional Name: 4-[(4-methyl-6-morpholino-s-triazin-2-yl)amino]besylic acid Formula: C14H17N5O4S MolecularWeight: 351.38088

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC(=N1)NC2=CC=C(C=C2)S(=O)(=O)O)N3CCOCC3

Isomeric SMILES

CC1=NC(=NC(=N1)NC2=CC=C(C=C2)S(=O)(=O)O)N3CCOCC3

InChI

InChI=1S/C14H17N5O4S/c1-10-15-13(18-14(16-10)19-6-8-23-9-7-19)17-11-2-4-12(5-3-11)24(20,21)22/h2-5H,6-9H2,1H3,(H,20,21,22)(H,15,16,17,18)