N-[5-[(3-chloranyl-4-methyl-phenyl)methyl]-1,3-thiazol-2-yl]-3-(4-methylphenyl)sulfonyl-propanamide

Systemtic Name: N-[5-[(3-chloranyl-4-methyl-phenyl)methyl]-1,3-thiazol-2-yl]-3-(4-methylphenyl)sulfonyl-propanamide Openeye Name: N-[5-[(3-chloro-4-methyl-phenyl)methyl]thiazol-2-yl]-3-(p-tolylsulfonyl)propanamide CAS Name: N-[5-[(3-chloro-4-methylphenyl)methyl]-2-thiazolyl]-3-(4-methylphenyl)sulfonylpropanamide IUPAC Name: N-[5-[(3-chloro-4-methylphenyl)methyl]-1,3-thiazol-2-yl]-3-(4-methylphenyl)sulfonylpropanamide Traditional Name: N-[5-(3-chloro-4-methyl-benzyl)thiazol-2-yl]-3-tosyl-propionamide Formula: C21H21ClN2O3S2 MolecularWeight: 448.98604

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CCC(=O)NC2=NC=C(S2)CC3=CC(=C(C=C3)C)Cl

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CCC(=O)NC2=NC=C(S2)CC3=CC(=C(C=C3)C)Cl

InChI

InChI=1S/C21H21ClN2O3S2/c1-14-3-7-18(8-4-14)29(26,27)10-9-20(25)24-21-23-13-17(28-21)11-16-6-5-15(2)19(22)12-16/h3-8,12-13H,9-11H2,1-2H3,(H,23,24,25)