(4-pyridin-1-ium-2-ylpiperazin-1-yl)-(1-thiophen-2-ylsulfonylpiperidin-4-yl)methanone

Systemtic Name: (4-pyridin-1-ium-2-ylpiperazin-1-yl)-(1-thiophen-2-ylsulfonylpiperidin-4-yl)methanone Openeye Name: (4-pyridin-1-ium-2-ylpiperazin-1-yl)-[1-(2-thienylsulfonyl)-4-piperidyl]methanone CAS Name: [4-(2-pyridin-1-iumyl)-1-piperazinyl]-(1-thiophen-2-ylsulfonyl-4-piperidinyl)methanone IUPAC Name: (4-pyridin-1-ium-2-ylpiperazin-1-yl)-(1-thiophen-2-ylsulfonylpiperidin-4-yl)methanone Traditional Name: (4-pyridin-1-ium-2-ylpiperazino)-[1-(2-thienylsulfonyl)-4-piperidyl]methanone Formula: C19H25N4O3S2+ MolecularWeight: 421.5568

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N2CCN(CC2)C3=CC=CC=[NH+]3)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

C1CN(CCC1C(=O)N2CCN(CC2)C3=CC=CC=[NH+]3)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C19H24N4O3S2/c24-19(22-13-11-21(12-14-22)17-4-1-2-8-20-17)16-6-9-23(10-7-16)28(25,26)18-5-3-15-27-18/h1-5,8,15-16H,6-7,9-14H2/p+1