2-chloranyl-N-[2-(4-methylpiperazin-1-yl)ethyl]-5-thiomorpholin-4-ylsulfonyl-benzamide

Systemtic Name: 2-chloranyl-N-[2-(4-methylpiperazin-1-yl)ethyl]-5-thiomorpholin-4-ylsulfonyl-benzamide Openeye Name: 2-chloro-N-[2-(4-methylpiperazin-1-yl)ethyl]-5-thiomorpholinosulfonyl-benzamide CAS Name: 2-chloro-N-[2-(4-methyl-1-piperazinyl)ethyl]-5-thiomorpholin-4-ylsulfonylbenzamide IUPAC Name: 2-chloro-N-[2-(4-methylpiperazin-1-yl)ethyl]-5-thiomorpholin-4-ylsulfonylbenzamide Traditional Name: 2-chloro-N-[2-(4-methylpiperazino)ethyl]-5-thiomorpholinosulfonyl-benzamide Formula: C18H27ClN4O3S2 MolecularWeight: 447.01498

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CCNC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCSCC3)Cl

Isomeric SMILES

CN1CCN(CC1)CCNC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCSCC3)Cl

InChI

InChI=1S/C18H27ClN4O3S2/c1-21-6-8-22(9-7-21)5-4-20-18(24)16-14-15(2-3-17(16)19)28(25,26)23-10-12-27-13-11-23/h2-3,14H,4-13H2,1H3,(H,20,24)