N-[3-(dimethylsulfamoyl)-4-methyl-phenyl]-2-(2-thiophen-2-ylquinazolin-4-yl)sulfanyl-ethanamide

Systemtic Name: N-[3-(dimethylsulfamoyl)-4-methyl-phenyl]-2-(2-thiophen-2-ylquinazolin-4-yl)sulfanyl-ethanamide Openeye Name: N-[3-(dimethylsulfamoyl)-4-methyl-phenyl]-2-[2-(2-thienyl)quinazolin-4-yl]sulfanyl-acetamide CAS Name: N-[3-(dimethylsulfamoyl)-4-methylphenyl]-2-[(2-thiophen-2-yl-4-quinazolinyl)thio]acetamide IUPAC Name: N-[3-(dimethylsulfamoyl)-4-methylphenyl]-2-(2-thiophen-2-ylquinazolin-4-yl)sulfanylacetamide Traditional Name: N-[3-(dimethylsulfamoyl)-4-methyl-phenyl]-2-[[2-(2-thienyl)quinazolin-4-yl]thio]acetamide Formula: C23H22N4O3S3 MolecularWeight: 498.64078

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CSC2=NC(=NC3=CC=CC=C32)C4=CC=CS4)S(=O)(=O)N(C)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CSC2=NC(=NC3=CC=CC=C32)C4=CC=CS4)S(=O)(=O)N(C)C

InChI

InChI=1S/C23H22N4O3S3/c1-15-10-11-16(13-20(15)33(29,30)27(2)3)24-21(28)14-32-23-17-7-4-5-8-18(17)25-22(26-23)19-9-6-12-31-19/h4-13H,14H2,1-3H3,(H,24,28)