N-(2,3-dimethyl-5-sulfamoyl-phenyl)-2-[4-(ethylamino)quinazolin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(2,3-dimethyl-5-sulfamoyl-phenyl)-2-[4-(ethylamino)quinazolin-2-yl]sulfanyl-ethanamide Openeye Name: N-(2,3-dimethyl-5-sulfamoyl-phenyl)-2-[4-(ethylamino)quinazolin-2-yl]sulfanyl-acetamide CAS Name: N-(2,3-dimethyl-5-sulfamoylphenyl)-2-[[4-(ethylamino)-2-quinazolinyl]thio]acetamide IUPAC Name: N-(2,3-dimethyl-5-sulfamoylphenyl)-2-[4-(ethylamino)quinazolin-2-yl]sulfanylacetamide Traditional Name: N-(2,3-dimethyl-5-sulfamoyl-phenyl)-2-[[4-(ethylamino)quinazolin-2-yl]thio]acetamide Formula: C20H23N5O3S2 MolecularWeight: 445.55832

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=NC(=NC2=CC=CC=C21)SCC(=O)NC3=C(C(=CC(=C3)S(=O)(=O)N)C)C

Isomeric SMILES

CCNC1=NC(=NC2=CC=CC=C21)SCC(=O)NC3=C(C(=CC(=C3)S(=O)(=O)N)C)C

InChI

InChI=1S/C20H23N5O3S2/c1-4-22-19-15-7-5-6-8-16(15)24-20(25-19)29-11-18(26)23-17-10-14(30(21,27)28)9-12(2)13(17)3/h5-10H,4,11H2,1-3H3,(H,23,26)(H2,21,27,28)(H,22,24,25)