[(1S)-1-[4-azanyl-6-(dimethylamino)-1,3,5-triazin-2-yl]ethyl] 4-methylsulfonylbenzoate

Systemtic Name: [(1S)-1-[4-azanyl-6-(dimethylamino)-1,3,5-triazin-2-yl]ethyl] 4-methylsulfonylbenzoate Openeye Name: [(1S)-1-[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]ethyl] 4-methylsulfonylbenzoate CAS Name: 4-methylsulfonylbenzoic acid [(1S)-1-[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]ethyl] ester IUPAC Name: [(1S)-1-[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]ethyl] 4-methylsulfonylbenzoate Traditional Name: 4-mesylbenzoic acid [(1S)-1-[4-amino-6-(dimethylamino)-s-triazin-2-yl]ethyl] ester Formula: C15H19N5O4S MolecularWeight: 365.40746

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC(=NC(=N1)N(C)C)N)OC(=O)C2=CC=C(C=C2)S(=O)(=O)C

Isomeric SMILES

C[C@@H](C1=NC(=NC(=N1)N(C)C)N)OC(=O)C2=CC=C(C=C2)S(=O)(=O)C

InChI

InChI=1S/C15H19N5O4S/c1-9(12-17-14(16)19-15(18-12)20(2)3)24-13(21)10-5-7-11(8-6-10)25(4,22)23/h5-9H,1-4H3,(H2,16,17,18,19)/t9-/m0/s1