2-chloranyl-N-[(2,4-dimethoxyphenyl)methyl]-5-thiomorpholin-4-ylsulfonyl-benzamide

Systemtic Name: 2-chloranyl-N-[(2,4-dimethoxyphenyl)methyl]-5-thiomorpholin-4-ylsulfonyl-benzamide Openeye Name: 2-chloro-N-[(2,4-dimethoxyphenyl)methyl]-5-thiomorpholinosulfonyl-benzamide CAS Name: 2-chloro-N-[(2,4-dimethoxyphenyl)methyl]-5-thiomorpholin-4-ylsulfonylbenzamide IUPAC Name: 2-chloro-N-[(2,4-dimethoxyphenyl)methyl]-5-thiomorpholin-4-ylsulfonylbenzamide Traditional Name: 2-chloro-N-(2,4-dimethoxybenzyl)-5-thiomorpholinosulfonyl-benzamide Formula: C20H23ClN2O5S2 MolecularWeight: 470.99002

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)CNC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCSCC3)Cl)OC

Isomeric SMILES

COC1=CC(=C(C=C1)CNC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCSCC3)Cl)OC

InChI

InChI=1S/C20H23ClN2O5S2/c1-27-15-4-3-14(19(11-15)28-2)13-22-20(24)17-12-16(5-6-18(17)21)30(25,26)23-7-9-29-10-8-23/h3-6,11-12H,7-10,13H2,1-2H3,(H,22,24)