N-[3-(dimethylsulfamoyl)-4-ethoxy-phenyl]-2-quinazolin-4-ylsulfanyl-ethanamide

Systemtic Name: N-[3-(dimethylsulfamoyl)-4-ethoxy-phenyl]-2-quinazolin-4-ylsulfanyl-ethanamide Openeye Name: N-[3-(dimethylsulfamoyl)-4-ethoxy-phenyl]-2-quinazolin-4-ylsulfanyl-acetamide CAS Name: N-[3-(dimethylsulfamoyl)-4-ethoxyphenyl]-2-(4-quinazolinylthio)acetamide IUPAC Name: N-[3-(dimethylsulfamoyl)-4-ethoxyphenyl]-2-quinazolin-4-ylsulfanylacetamide Traditional Name: N-[3-(dimethylsulfamoyl)-4-ethoxy-phenyl]-2-(quinazolin-4-ylthio)acetamide Formula: C20H22N4O4S2 MolecularWeight: 446.54308

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NC(=O)CSC2=NC=NC3=CC=CC=C32)S(=O)(=O)N(C)C

Isomeric SMILES

CCOC1=C(C=C(C=C1)NC(=O)CSC2=NC=NC3=CC=CC=C32)S(=O)(=O)N(C)C

InChI

InChI=1S/C20H22N4O4S2/c1-4-28-17-10-9-14(11-18(17)30(26,27)24(2)3)23-19(25)12-29-20-15-7-5-6-8-16(15)21-13-22-20/h5-11,13H,4,12H2,1-3H3,(H,23,25)