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

Systemtic Name: N-[1,1-bis(oxidanylidene)thiolan-3-yl]-3-(4-methylpiperazin-1-yl)sulfonyl-N-propyl-benzamide Openeye Name: N-(1,1-dioxothiolan-3-yl)-3-(4-methylpiperazin-1-yl)sulfonyl-N-propyl-benzamide CAS Name: N-(1,1-dioxo-3-thiolanyl)-3-[(4-methyl-1-piperazinyl)sulfonyl]-N-propylbenzamide IUPAC Name: N-(1,1-dioxothiolan-3-yl)-3-(4-methylpiperazin-1-yl)sulfonyl-N-propylbenzamide Traditional Name: N-(1,1-diketothiolan-3-yl)-3-(4-methylpiperazino)sulfonyl-N-propyl-benzamide Formula: C19H29N3O5S2 MolecularWeight: 443.58066

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H29N3O5S2/c1-3-8-22(17-7-13-28(24,25)15-17)19(23)16-5-4-6-18(14-16)29(26,27)21-11-9-20(2)10-12-21/h4-6,14,17H,3,7-13,15H2,1-2H3