methyl 2-[2-[(4-morpholin-4-yl-6-phenylazanyl-1,3,5-triazin-2-yl)sulfanyl]ethanoylamino]benzoate

Systemtic Name: methyl 2-[2-[(4-morpholin-4-yl-6-phenylazanyl-1,3,5-triazin-2-yl)sulfanyl]ethanoylamino]benzoate Openeye Name: methyl 2-[[2-[(4-anilino-6-morpholino-1,3,5-triazin-2-yl)sulfanyl]acetyl]amino]benzoate CAS Name: 2-[[2-[[4-anilino-6-(4-morpholinyl)-1,3,5-triazin-2-yl]thio]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[2-[(4-anilino-6-morpholin-4-yl-1,3,5-triazin-2-yl)sulfanyl]acetyl]amino]benzoate Traditional Name: 2-[[2-[(4-anilino-6-morpholino-s-triazin-2-yl)thio]acetyl]amino]benzoic acid methyl ester Formula: C23H24N6O4S MolecularWeight: 480.53946

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1NC(=O)CSC2=NC(=NC(=N2)NC3=CC=CC=C3)N4CCOCC4

Isomeric SMILES

COC(=O)C1=CC=CC=C1NC(=O)CSC2=NC(=NC(=N2)NC3=CC=CC=C3)N4CCOCC4

InChI

InChI=1S/C23H24N6O4S/c1-32-20(31)17-9-5-6-10-18(17)25-19(30)15-34-23-27-21(24-16-7-3-2-4-8-16)26-22(28-23)29-11-13-33-14-12-29/h2-10H,11-15H2,1H3,(H,25,30)(H,24,26,27,28)