2-chloranyl-N-(2,5-dimethylphenyl)-5-thiomorpholin-4-ylsulfonyl-benzamide

Systemtic Name: 2-chloranyl-N-(2,5-dimethylphenyl)-5-thiomorpholin-4-ylsulfonyl-benzamide Openeye Name: 2-chloro-N-(2,5-dimethylphenyl)-5-thiomorpholinosulfonyl-benzamide CAS Name: 2-chloro-N-(2,5-dimethylphenyl)-5-thiomorpholin-4-ylsulfonylbenzamide IUPAC Name: 2-chloro-N-(2,5-dimethylphenyl)-5-thiomorpholin-4-ylsulfonylbenzamide Traditional Name: 2-chloro-N-(2,5-dimethylphenyl)-5-thiomorpholinosulfonyl-benzamide Formula: C19H21ClN2O3S2 MolecularWeight: 424.96464

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCSCC3)Cl

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCSCC3)Cl

InChI

InChI=1S/C19H21ClN2O3S2/c1-13-3-4-14(2)18(11-13)21-19(23)16-12-15(5-6-17(16)20)27(24,25)22-7-9-26-10-8-22/h3-6,11-12H,7-10H2,1-2H3,(H,21,23)