2-[6-[(4-acetamidophenyl)sulfonylamino]-2,4-dihydro-1H-1,3,5-triazin-3-yl]ethyl benzoate

Systemtic Name: 2-[6-[(4-acetamidophenyl)sulfonylamino]-2,4-dihydro-1H-1,3,5-triazin-3-yl]ethyl benzoate Openeye Name: 2-[6-[(4-acetamidophenyl)sulfonylamino]-2,4-dihydro-1H-1,3,5-triazin-3-yl]ethyl benzoate CAS Name: benzoic acid 2-[6-[(4-acetamidophenyl)sulfonylamino]-2,4-dihydro-1H-1,3,5-triazin-3-yl]ethyl ester IUPAC Name: 2-[6-[(4-acetamidophenyl)sulfonylamino]-2,4-dihydro-1H-1,3,5-triazin-3-yl]ethyl benzoate Traditional Name: benzoic acid 2-[6-[(4-acetamidophenyl)sulfonylamino]-2,4-dihydro-1H-s-triazin-3-yl]ethyl ester Formula: C20H23N5O5S MolecularWeight: 445.49212

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)NC2=NCN(CN2)CCOC(=O)C3=CC=CC=C3

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)NC2=NCN(CN2)CCOC(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H23N5O5S/c1-15(26)23-17-7-9-18(10-8-17)31(28,29)24-20-21-13-25(14-22-20)11-12-30-19(27)16-5-3-2-4-6-16/h2-10H,11-14H2,1H3,(H,23,26)(H2,21,22,24)