4-(prop-2-ynylsulfamoyl)-N-[4-(2,4,5-trimethylphenyl)-1,3-thiazol-2-yl]benzamide

Systemtic Name: 4-(prop-2-ynylsulfamoyl)-N-[4-(2,4,5-trimethylphenyl)-1,3-thiazol-2-yl]benzamide Openeye Name: 4-(prop-2-ynylsulfamoyl)-N-[4-(2,4,5-trimethylphenyl)thiazol-2-yl]benzamide CAS Name: 4-(prop-2-ynylsulfamoyl)-N-[4-(2,4,5-trimethylphenyl)-2-thiazolyl]benzamide IUPAC Name: 4-(prop-2-ynylsulfamoyl)-N-[4-(2,4,5-trimethylphenyl)-1,3-thiazol-2-yl]benzamide Traditional Name: 4-(propargylsulfamoyl)-N-[4-(2,4,5-trimethylphenyl)thiazol-2-yl]benzamide Formula: C22H21N3O3S2 MolecularWeight: 439.55044

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C2=CSC(=N2)NC(=O)C3=CC=C(C=C3)S(=O)(=O)NCC#C)C)C

Isomeric SMILES

CC1=CC(=C(C=C1C2=CSC(=N2)NC(=O)C3=CC=C(C=C3)S(=O)(=O)NCC#C)C)C

InChI

InChI=1S/C22H21N3O3S2/c1-5-10-23-30(27,28)18-8-6-17(7-9-18)21(26)25-22-24-20(13-29-22)19-12-15(3)14(2)11-16(19)4/h1,6-9,11-13,23H,10H2,2-4H3,(H,24,25,26)