N-(4-azanyl-6-morpholin-4-yl-1,3,5-triazin-2-yl)-4-chloranyl-5-methyl-2-sulfanyl-benzenesulfonamide

Systemtic Name: N-(4-azanyl-6-morpholin-4-yl-1,3,5-triazin-2-yl)-4-chloranyl-5-methyl-2-sulfanyl-benzenesulfonamide Openeye Name: N-(4-amino-6-morpholino-1,3,5-triazin-2-yl)-4-chloro-5-methyl-2-sulfanyl-benzenesulfonamide CAS Name: N-[4-amino-6-(4-morpholinyl)-1,3,5-triazin-2-yl]-4-chloro-2-mercapto-5-methylbenzenesulfonamide IUPAC Name: N-(4-amino-6-morpholin-4-yl-1,3,5-triazin-2-yl)-4-chloro-5-methyl-2-sulfanylbenzenesulfonamide Traditional Name: N-(4-amino-6-morpholino-s-triazin-2-yl)-4-chloro-2-mercapto-5-methyl-benzenesulfonamide Formula: C14H17ClN6O3S2 MolecularWeight: 416.90618

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)S)S(=O)(=O)NC2=NC(=NC(=N2)N)N3CCOCC3

Isomeric SMILES

CC1=CC(=C(C=C1Cl)S)S(=O)(=O)NC2=NC(=NC(=N2)N)N3CCOCC3

InChI

InChI=1S/C14H17ClN6O3S2/c1-8-6-11(10(25)7-9(8)15)26(22,23)20-13-17-12(16)18-14(19-13)21-2-4-24-5-3-21/h6-7,25H,2-5H2,1H3,(H3,16,17,18,19,20)