2-chloranyl-N-[3-[methyl(phenyl)amino]propyl]-5-thiomorpholin-4-ylsulfonyl-benzamide

Systemtic Name: 2-chloranyl-N-[3-[methyl(phenyl)amino]propyl]-5-thiomorpholin-4-ylsulfonyl-benzamide Openeye Name: 2-chloro-N-[3-(N-methylanilino)propyl]-5-thiomorpholinosulfonyl-benzamide CAS Name: 2-chloro-N-[3-(N-methylanilino)propyl]-5-thiomorpholin-4-ylsulfonylbenzamide IUPAC Name: 2-chloro-N-[3-(N-methylanilino)propyl]-5-thiomorpholin-4-ylsulfonylbenzamide Traditional Name: 2-chloro-N-[3-(N-methylanilino)propyl]-5-thiomorpholinosulfonyl-benzamide Formula: C21H26ClN3O3S2 MolecularWeight: 468.03244

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCNC(=O)C1=C(C=CC(=C1)S(=O)(=O)N2CCSCC2)Cl)C3=CC=CC=C3

Isomeric SMILES

CN(CCCNC(=O)C1=C(C=CC(=C1)S(=O)(=O)N2CCSCC2)Cl)C3=CC=CC=C3

InChI

InChI=1S/C21H26ClN3O3S2/c1-24(17-6-3-2-4-7-17)11-5-10-23-21(26)19-16-18(8-9-20(19)22)30(27,28)25-12-14-29-15-13-25/h2-4,6-9,16H,5,10-15H2,1H3,(H,23,26)