2-chloranyl-N-[4-(3,4-dimethylphenyl)-1,3-thiazol-2-yl]-5-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: 2-chloranyl-N-[4-(3,4-dimethylphenyl)-1,3-thiazol-2-yl]-5-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: 2-chloro-N-[4-(3,4-dimethylphenyl)thiazol-2-yl]-5-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: 2-chloro-N-[4-(3,4-dimethylphenyl)-2-thiazolyl]-5-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: 2-chloro-N-[4-(3,4-dimethylphenyl)-1,3-thiazol-2-yl]-5-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: 2-chloro-N-[4-(3,4-dimethylphenyl)thiazol-2-yl]-5-pyrrolidinosulfonyl-benzamide Formula: C22H22ClN3O3S2 MolecularWeight: 476.01138

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=CSC(=N2)NC(=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCCC4)Cl)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=CSC(=N2)NC(=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCCC4)Cl)C

InChI

InChI=1S/C22H22ClN3O3S2/c1-14-5-6-16(11-15(14)2)20-13-30-22(24-20)25-21(27)18-12-17(7-8-19(18)23)31(28,29)26-9-3-4-10-26/h5-8,11-13H,3-4,9-10H2,1-2H3,(H,24,25,27)