N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-N-ethyl-3-(4-methylpiperazin-1-yl)sulfonyl-benzamide

Systemtic Name: N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-N-ethyl-3-(4-methylpiperazin-1-yl)sulfonyl-benzamide Openeye Name: N-[(3S)-1,1-dioxothiolan-3-yl]-N-ethyl-3-(4-methylpiperazin-1-yl)sulfonyl-benzamide CAS Name: N-[(3S)-1,1-dioxo-3-thiolanyl]-N-ethyl-3-[(4-methyl-1-piperazinyl)sulfonyl]benzamide IUPAC Name: N-[(3S)-1,1-dioxothiolan-3-yl]-N-ethyl-3-(4-methylpiperazin-1-yl)sulfonylbenzamide Traditional Name: N-[(3S)-1,1-diketothiolan-3-yl]-N-ethyl-3-(4-methylpiperazino)sulfonyl-benzamide Formula: C18H27N3O5S2 MolecularWeight: 429.55408

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1CCS(=O)(=O)C1)C(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCN(CC3)C

Isomeric SMILES

CCN([C@H]1CCS(=O)(=O)C1)C(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCN(CC3)C

InChI

InChI=1S/C18H27N3O5S2/c1-3-21(16-7-12-27(23,24)14-16)18(22)15-5-4-6-17(13-15)28(25,26)20-10-8-19(2)9-11-20/h4-6,13,16H,3,7-12,14H2,1-2H3/t16-/m0/s1