N-[3-(dimethylsulfamoyl)-4-methyl-phenyl]-2-[4-(methylamino)quinazolin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-[3-(dimethylsulfamoyl)-4-methyl-phenyl]-2-[4-(methylamino)quinazolin-2-yl]sulfanyl-ethanamide Openeye Name: N-[3-(dimethylsulfamoyl)-4-methyl-phenyl]-2-[4-(methylamino)quinazolin-2-yl]sulfanyl-acetamide CAS Name: N-[3-(dimethylsulfamoyl)-4-methylphenyl]-2-[[4-(methylamino)-2-quinazolinyl]thio]acetamide IUPAC Name: N-[3-(dimethylsulfamoyl)-4-methylphenyl]-2-[4-(methylamino)quinazolin-2-yl]sulfanylacetamide Traditional Name: N-[3-(dimethylsulfamoyl)-4-methyl-phenyl]-2-[[4-(methylamino)quinazolin-2-yl]thio]acetamide Formula: C20H23N5O3S2 MolecularWeight: 445.55832

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3C(=N2)NC)S(=O)(=O)N(C)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3C(=N2)NC)S(=O)(=O)N(C)C

InChI

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